Carbonyl compounds
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Ethyl Benzoylacetate 95.0+%, TCI America™
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CAS: 94-02-0 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00009196 InChI Key: GKKZMYDNDDMXSE-UHFFFAOYSA-N Synonym: ethyl benzoylacetate,benzoylacetic acid ethyl ester,ethyl benzoyl acetate,acetic acid, benzoyl-, ethyl ester,ethyl beta-oxobenzenepropanoate,ethylbenzoylacetate,benzoylacetic acid, ethyl ester,ethyl 3-phenyl-3-oxopropanoate,benzenepropanoic acid, beta-oxo-, ethyl ester,ethyl 3-oxo-3-phenylpropionate PubChem CID: 7170 IUPAC Name: ethyl 3-oxo-3-phenylpropanoate SMILES: CCOC(=O)CC(=O)C1=CC=CC=C1
| PubChem CID | 7170 |
|---|---|
| CAS | 94-02-0 |
| Molecular Weight (g/mol) | 192.214 |
| MDL Number | MFCD00009196 |
| SMILES | CCOC(=O)CC(=O)C1=CC=CC=C1 |
| Synonym | ethyl benzoylacetate,benzoylacetic acid ethyl ester,ethyl benzoyl acetate,acetic acid, benzoyl-, ethyl ester,ethyl beta-oxobenzenepropanoate,ethylbenzoylacetate,benzoylacetic acid, ethyl ester,ethyl 3-phenyl-3-oxopropanoate,benzenepropanoic acid, beta-oxo-, ethyl ester,ethyl 3-oxo-3-phenylpropionate |
| IUPAC Name | ethyl 3-oxo-3-phenylpropanoate |
| InChI Key | GKKZMYDNDDMXSE-UHFFFAOYSA-N |
| Molecular Formula | C11H12O3 |
3-tert-Butylsalicylaldehyde 95.0+%, TCI America™
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CAS: 24623-65-2 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.23 MDL Number: MFCD00778877 InChI Key: ROILLNJICXGZQQ-UHFFFAOYSA-N Synonym: 3-tert-butyl-2-hydroxybenzaldehyde,3-tert-butylsalicylaldehyde,3-t-butylsalicylaldehyde,benzaldehyde, 3-1,1-dimethylethyl-2-hydroxy,3-tert-butyl-2-hydroxy-benzaldehyde,3-tert-butyl salicylaldehyde,acmc-1ceew,3-tertbutylsalicylaldehyde,2-hydroxy-3-tert.butylbenzaldehyde,3-tert-butyl-2-oxidanyl-benzaldehyde PubChem CID: 3678675 IUPAC Name: 3-tert-butyl-2-hydroxybenzaldehyde SMILES: CC(C)(C)C1=CC=CC(C=O)=C1O
| PubChem CID | 3678675 |
|---|---|
| CAS | 24623-65-2 |
| Molecular Weight (g/mol) | 178.23 |
| MDL Number | MFCD00778877 |
| SMILES | CC(C)(C)C1=CC=CC(C=O)=C1O |
| Synonym | 3-tert-butyl-2-hydroxybenzaldehyde,3-tert-butylsalicylaldehyde,3-t-butylsalicylaldehyde,benzaldehyde, 3-1,1-dimethylethyl-2-hydroxy,3-tert-butyl-2-hydroxy-benzaldehyde,3-tert-butyl salicylaldehyde,acmc-1ceew,3-tertbutylsalicylaldehyde,2-hydroxy-3-tert.butylbenzaldehyde,3-tert-butyl-2-oxidanyl-benzaldehyde |
| IUPAC Name | 3-tert-butyl-2-hydroxybenzaldehyde |
| InChI Key | ROILLNJICXGZQQ-UHFFFAOYSA-N |
| Molecular Formula | C11H14O2 |
4'-Propoxyacetophenone 98.0+%, TCI America™
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CAS: 5736-86-7 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.231 MDL Number: MFCD01922144 InChI Key: RTYYKCQJSTZADZ-UHFFFAOYSA-N PubChem CID: 260132 IUPAC Name: 1-(4-propoxyphenyl)ethanone SMILES: CCCOC1=CC=C(C=C1)C(=O)C
| PubChem CID | 260132 |
|---|---|
| CAS | 5736-86-7 |
| Molecular Weight (g/mol) | 178.231 |
| MDL Number | MFCD01922144 |
| SMILES | CCCOC1=CC=C(C=C1)C(=O)C |
| IUPAC Name | 1-(4-propoxyphenyl)ethanone |
| InChI Key | RTYYKCQJSTZADZ-UHFFFAOYSA-N |
| Molecular Formula | C11H14O2 |
5,6-Dimethoxy-2-(4-piperidylmethyl)-1-indanone Hydrochloride 98.0+%, TCI America™
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CAS: 120013-39-0 Molecular Formula: C17H24ClNO3 Molecular Weight (g/mol): 325.83 MDL Number: MFCD09033179 InChI Key: WOZXDQQCMZIQEG-UHFFFAOYNA-N PubChem CID: 14553606 IUPAC Name: 5,6-dimethoxy-2-[(piperidin-4-yl)methyl]-2,3-dihydro-1H-inden-1-one hydrochloride SMILES: Cl.COC1=C(OC)C=C2C(=O)C(CC3CCNCC3)CC2=C1
| PubChem CID | 14553606 |
|---|---|
| CAS | 120013-39-0 |
| Molecular Weight (g/mol) | 325.83 |
| MDL Number | MFCD09033179 |
| SMILES | Cl.COC1=C(OC)C=C2C(=O)C(CC3CCNCC3)CC2=C1 |
| IUPAC Name | 5,6-dimethoxy-2-[(piperidin-4-yl)methyl]-2,3-dihydro-1H-inden-1-one hydrochloride |
| InChI Key | WOZXDQQCMZIQEG-UHFFFAOYNA-N |
| Molecular Formula | C17H24ClNO3 |
5-Bromo-2-pyridinecarboxaldehyde 98.0+%, TCI America™
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CAS: 31181-90-5 Molecular Formula: C6H4BrNO Molecular Weight (g/mol): 186.008 MDL Number: MFCD04112535 InChI Key: ZQVLPMNLLKGGIU-UHFFFAOYSA-N Synonym: 5-bromopicolinaldehyde,5-bromo-2-formylpyridine,5-bromo-2-pyridinecarboxaldehyde,5-bromopyridine-2-carboxaldehyde,5-bromo-pyridine-2-carbaldehyde,5-bromo-2-pyridinecarbaldehyde,2-pyridinecarboxaldehyde, 5-bromo,5-bromo-2-pyridine-carbaldehyde,pubchem5059,5-bromo picolinaldehyde PubChem CID: 9877562 IUPAC Name: 5-bromopyridine-2-carbaldehyde SMILES: C1=CC(=NC=C1Br)C=O
| PubChem CID | 9877562 |
|---|---|
| CAS | 31181-90-5 |
| Molecular Weight (g/mol) | 186.008 |
| MDL Number | MFCD04112535 |
| SMILES | C1=CC(=NC=C1Br)C=O |
| Synonym | 5-bromopicolinaldehyde,5-bromo-2-formylpyridine,5-bromo-2-pyridinecarboxaldehyde,5-bromopyridine-2-carboxaldehyde,5-bromo-pyridine-2-carbaldehyde,5-bromo-2-pyridinecarbaldehyde,2-pyridinecarboxaldehyde, 5-bromo,5-bromo-2-pyridine-carbaldehyde,pubchem5059,5-bromo picolinaldehyde |
| IUPAC Name | 5-bromopyridine-2-carbaldehyde |
| InChI Key | ZQVLPMNLLKGGIU-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrNO |
2',4'-Dichloro-5'-fluoroacetophenone 98.0+%, TCI America™
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CAS: 704-10-9 Molecular Formula: C8H5Cl2FO Molecular Weight (g/mol): 207.03 MDL Number: MFCD00077499 InChI Key: FAKJFAMIABOKBW-UHFFFAOYSA-N Synonym: 2',4'-dichloro-5'-fluoroacetophenone,1-2,4-dichloro-5-fluorophenyl ethanone,2,4-dichloro-5-fluoroacetophenone,1-2,4-dichloro-5-fluorophenyl ethan-1-one,dcfa,acetophenone, 2',4'-dichloro-5'-fluoro,6-acetyl-1,3-dichloro-4-fluorobenzene,1-2,4-dichloro-5-fluoro-phenyl ethanone,ethanone, 1-2,4-dichloro-5-fluorophenyl,1-acetyl-2,4-dichloro-5-fluorobenzene PubChem CID: 727250 IUPAC Name: 1-(2,4-dichloro-5-fluorophenyl)ethan-1-one SMILES: CC(=O)C1=CC(F)=C(Cl)C=C1Cl
| PubChem CID | 727250 |
|---|---|
| CAS | 704-10-9 |
| Molecular Weight (g/mol) | 207.03 |
| MDL Number | MFCD00077499 |
| SMILES | CC(=O)C1=CC(F)=C(Cl)C=C1Cl |
| Synonym | 2',4'-dichloro-5'-fluoroacetophenone,1-2,4-dichloro-5-fluorophenyl ethanone,2,4-dichloro-5-fluoroacetophenone,1-2,4-dichloro-5-fluorophenyl ethan-1-one,dcfa,acetophenone, 2',4'-dichloro-5'-fluoro,6-acetyl-1,3-dichloro-4-fluorobenzene,1-2,4-dichloro-5-fluoro-phenyl ethanone,ethanone, 1-2,4-dichloro-5-fluorophenyl,1-acetyl-2,4-dichloro-5-fluorobenzene |
| IUPAC Name | 1-(2,4-dichloro-5-fluorophenyl)ethan-1-one |
| InChI Key | FAKJFAMIABOKBW-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl2FO |
Nonadecanophenone 97.0+%, TCI America™
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CAS: 103044-68-4 Molecular Formula: C25H42O Molecular Weight (g/mol): 358.61 MDL Number: MFCD00094242 InChI Key: WTWRNRBSHQDWMY-UHFFFAOYSA-N Synonym: Octadecyl Phenyl Ketone PubChem CID: 4657534 IUPAC Name: 1-phenylnonadecan-1-one SMILES: CCCCCCCCCCCCCCCCCCC(=O)C1=CC=CC=C1
| PubChem CID | 4657534 |
|---|---|
| CAS | 103044-68-4 |
| Molecular Weight (g/mol) | 358.61 |
| MDL Number | MFCD00094242 |
| SMILES | CCCCCCCCCCCCCCCCCCC(=O)C1=CC=CC=C1 |
| Synonym | Octadecyl Phenyl Ketone |
| IUPAC Name | 1-phenylnonadecan-1-one |
| InChI Key | WTWRNRBSHQDWMY-UHFFFAOYSA-N |
| Molecular Formula | C25H42O |
3',5'-Dichloro-2,2,2-trifluoroacetophenone 96.0+%, TCI America™
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CAS: 130336-16-2 Molecular Formula: C8H3Cl2F3O Molecular Weight (g/mol): 243.006 MDL Number: MFCD01319996 InChI Key: DZDSQRPDUCSOQV-UHFFFAOYSA-N PubChem CID: 2758231 IUPAC Name: 1-(3,5-dichlorophenyl)-2,2,2-trifluoroethanone SMILES: C1=C(C=C(C=C1Cl)Cl)C(=O)C(F)(F)F
| PubChem CID | 2758231 |
|---|---|
| CAS | 130336-16-2 |
| Molecular Weight (g/mol) | 243.006 |
| MDL Number | MFCD01319996 |
| SMILES | C1=C(C=C(C=C1Cl)Cl)C(=O)C(F)(F)F |
| IUPAC Name | 1-(3,5-dichlorophenyl)-2,2,2-trifluoroethanone |
| InChI Key | DZDSQRPDUCSOQV-UHFFFAOYSA-N |
| Molecular Formula | C8H3Cl2F3O |
3,4,5-Tris(dodecyloxy)benzaldehyde 98.0+%, TCI America™
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CAS: 117241-32-4 Molecular Formula: C43H78O4 Molecular Weight (g/mol): 659.093 MDL Number: MFCD29917550 InChI Key: ABDPYSIFPMBTOS-UHFFFAOYSA-N PubChem CID: 14196731 IUPAC Name: 3,4,5-tridodecoxybenzaldehyde SMILES: CCCCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCCCC)OCCCCCCCCCCCC)C=O
| PubChem CID | 14196731 |
|---|---|
| CAS | 117241-32-4 |
| Molecular Weight (g/mol) | 659.093 |
| MDL Number | MFCD29917550 |
| SMILES | CCCCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCCCC)OCCCCCCCCCCCC)C=O |
| IUPAC Name | 3,4,5-tridodecoxybenzaldehyde |
| InChI Key | ABDPYSIFPMBTOS-UHFFFAOYSA-N |
| Molecular Formula | C43H78O4 |
3',4'-Dichloroacetophenone 98.0+%, TCI America™
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CAS: 2642-63-9 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.04 MDL Number: MFCD00000553 InChI Key: WBPAOUHWPONFEQ-UHFFFAOYSA-N Synonym: 3',4'-dichloroacetophenone,1-3,4-dichlorophenyl ethanone,3,4-dichloroacetophenone,1-3,4-dichlorophenyl ethan-1-one,ethanone, 1-3,4-dichlorophenyl,acetophenone, 3',4'-dichloro,1-acetyl-3,4-dichlorobenzene,3,4 dichloro acetophenone,pubchem3383,3,4-dicloroacetophenone PubChem CID: 75841 IUPAC Name: 1-(3,4-dichlorophenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(Cl)C(Cl)=C1
| PubChem CID | 75841 |
|---|---|
| CAS | 2642-63-9 |
| Molecular Weight (g/mol) | 189.04 |
| MDL Number | MFCD00000553 |
| SMILES | CC(=O)C1=CC=C(Cl)C(Cl)=C1 |
| Synonym | 3',4'-dichloroacetophenone,1-3,4-dichlorophenyl ethanone,3,4-dichloroacetophenone,1-3,4-dichlorophenyl ethan-1-one,ethanone, 1-3,4-dichlorophenyl,acetophenone, 3',4'-dichloro,1-acetyl-3,4-dichlorobenzene,3,4 dichloro acetophenone,pubchem3383,3,4-dicloroacetophenone |
| IUPAC Name | 1-(3,4-dichlorophenyl)ethan-1-one |
| InChI Key | WBPAOUHWPONFEQ-UHFFFAOYSA-N |
| Molecular Formula | C8H6Cl2O |
2-Bromo-4'-fluoro-3'-(trifluoromethyl)acetophenone 98.0+%, TCI America™
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CAS: 537050-14-9 Molecular Formula: C9H5BrF4O Molecular Weight (g/mol): 285.036 MDL Number: MFCD03094509 InChI Key: BUNOSKWLVXNWEH-UHFFFAOYSA-N Synonym: 4-fluoro-3-trifluoromethyl phenacyl bromide,2-bromo-1-4-fluoro-3-trifluoromethyl phenyl ethanone,4-fluoro-3-trifluoromethyl phenacylbromid,4-fluoro-3-trifluoromethyl phenacyl bromid,2-bromo-1-4-fluoro-3-trifluoromethyl phenyl ethan-1-one,2-bromo-4'-fluoro-3'-trifluoromethyl acetophenone,4-fluoro-3-trifluoromethyl phenacylbromide,2-bromo-4'-fluoro-3'-trifluoromethylacetophenone,acmc-209l9v PubChem CID: 2778787 IUPAC Name: 2-bromo-1-[4-fluoro-3-(trifluoromethyl)phenyl]ethanone SMILES: C1=CC(=C(C=C1C(=O)CBr)C(F)(F)F)F
| PubChem CID | 2778787 |
|---|---|
| CAS | 537050-14-9 |
| Molecular Weight (g/mol) | 285.036 |
| MDL Number | MFCD03094509 |
| SMILES | C1=CC(=C(C=C1C(=O)CBr)C(F)(F)F)F |
| Synonym | 4-fluoro-3-trifluoromethyl phenacyl bromide,2-bromo-1-4-fluoro-3-trifluoromethyl phenyl ethanone,4-fluoro-3-trifluoromethyl phenacylbromid,4-fluoro-3-trifluoromethyl phenacyl bromid,2-bromo-1-4-fluoro-3-trifluoromethyl phenyl ethan-1-one,2-bromo-4'-fluoro-3'-trifluoromethyl acetophenone,4-fluoro-3-trifluoromethyl phenacylbromide,2-bromo-4'-fluoro-3'-trifluoromethylacetophenone,acmc-209l9v |
| IUPAC Name | 2-bromo-1-[4-fluoro-3-(trifluoromethyl)phenyl]ethanone |
| InChI Key | BUNOSKWLVXNWEH-UHFFFAOYSA-N |
| Molecular Formula | C9H5BrF4O |
4-Heptyloxybenzaldehyde 98.0+%, TCI America™
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CAS: 27893-41-0 Molecular Formula: C14H20O2 Molecular Weight (g/mol): 220.312 MDL Number: MFCD00016616 InChI Key: YBCKMIZXHKVONZ-UHFFFAOYSA-N Synonym: 4-heptyloxybenzaldehyde,4-heptyloxy benzaldehyde,p-heptyloxybenzaldehyde,4-n-heptyloxybenzaldehyde,benzaldehyde, 4-heptyloxy,p-heptyloxy benzaldehyde,4-n-heptoxybenzaldehyde,4-heptyloxy-benzaldehyde,p-n-heptoxybenzaldehyde,acmc-209gzj PubChem CID: 119740 IUPAC Name: 4-heptoxybenzaldehyde SMILES: CCCCCCCOC1=CC=C(C=C1)C=O
| PubChem CID | 119740 |
|---|---|
| CAS | 27893-41-0 |
| Molecular Weight (g/mol) | 220.312 |
| MDL Number | MFCD00016616 |
| SMILES | CCCCCCCOC1=CC=C(C=C1)C=O |
| Synonym | 4-heptyloxybenzaldehyde,4-heptyloxy benzaldehyde,p-heptyloxybenzaldehyde,4-n-heptyloxybenzaldehyde,benzaldehyde, 4-heptyloxy,p-heptyloxy benzaldehyde,4-n-heptoxybenzaldehyde,4-heptyloxy-benzaldehyde,p-n-heptoxybenzaldehyde,acmc-209gzj |
| IUPAC Name | 4-heptoxybenzaldehyde |
| InChI Key | YBCKMIZXHKVONZ-UHFFFAOYSA-N |
| Molecular Formula | C14H20O2 |
3-Phenylpropionaldehyde 93.0+%, TCI America™
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CAS: 104-53-0 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.178 MDL Number: MFCD00007021 InChI Key: YGCZTXZTJXYWCO-UHFFFAOYSA-N Synonym: benzenepropanal,3-phenylpropionaldehyde,hydrocinnamaldehyde,hydrocinnamic aldehyde,dihydrocinnamaldehyde,benzylacetaldehyde,3-phenyl-1-propanal,3-phenylpropylaldehyde,3-phenylpropyl aldehyde,propanal, phenyl PubChem CID: 7707 IUPAC Name: 3-phenylpropanal SMILES: C1=CC=C(C=C1)CCC=O
| PubChem CID | 7707 |
|---|---|
| CAS | 104-53-0 |
| Molecular Weight (g/mol) | 134.178 |
| MDL Number | MFCD00007021 |
| SMILES | C1=CC=C(C=C1)CCC=O |
| Synonym | benzenepropanal,3-phenylpropionaldehyde,hydrocinnamaldehyde,hydrocinnamic aldehyde,dihydrocinnamaldehyde,benzylacetaldehyde,3-phenyl-1-propanal,3-phenylpropylaldehyde,3-phenylpropyl aldehyde,propanal, phenyl |
| IUPAC Name | 3-phenylpropanal |
| InChI Key | YGCZTXZTJXYWCO-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
2',6'-Difluoroacetophenone 98.0+%, TCI America™
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CAS: 13670-99-0 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.13 MDL Number: MFCD00000328 InChI Key: VGIIILXIQLXVLC-UHFFFAOYSA-N Synonym: 2',6'-difluoroacetophenone,1-2,6-difluorophenyl ethanone,2,6-difluoroacetophenone,1-2,6-difluorophenyl ethan-1-one,ethanone, 1-2,6-difluorophenyl,acetophenone, 2',6'-difluoro,1-acetyl-2,6-difluorobenzene,fr cf bv1,pubchem4218,intermediates-zcf02054 PubChem CID: 83643 IUPAC Name: 1-(2,6-difluorophenyl)ethan-1-one SMILES: CC(=O)C1=C(F)C=CC=C1F
| PubChem CID | 83643 |
|---|---|
| CAS | 13670-99-0 |
| Molecular Weight (g/mol) | 156.13 |
| MDL Number | MFCD00000328 |
| SMILES | CC(=O)C1=C(F)C=CC=C1F |
| Synonym | 2',6'-difluoroacetophenone,1-2,6-difluorophenyl ethanone,2,6-difluoroacetophenone,1-2,6-difluorophenyl ethan-1-one,ethanone, 1-2,6-difluorophenyl,acetophenone, 2',6'-difluoro,1-acetyl-2,6-difluorobenzene,fr cf bv1,pubchem4218,intermediates-zcf02054 |
| IUPAC Name | 1-(2,6-difluorophenyl)ethan-1-one |
| InChI Key | VGIIILXIQLXVLC-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O |
2,6-Dimethyl-5-heptenal 85.0+%, TCI America™
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CAS: 106-72-9 Molecular Formula: C9H16O Molecular Weight (g/mol): 140.226 MDL Number: MFCD00006981 InChI Key: YGFGZTXGYTUXBA-UHFFFAOYSA-N Synonym: 2,6-dimethyl-5-heptenal,melonal,5-heptenal, 2,6-dimethyl,bergamal,2,6-dimethyl-5-hepten-1-al,2,6-dimethyl-5-heptanal,2,6-dimethylhept-5-en-1-al,fema no. 2389,2,6-dimethyl-2-hepten-7-al,2,6-dimethyl-5-heptenal natural PubChem CID: 61016 IUPAC Name: 2,6-dimethylhept-5-enal SMILES: CC(CCC=C(C)C)C=O
| PubChem CID | 61016 |
|---|---|
| CAS | 106-72-9 |
| Molecular Weight (g/mol) | 140.226 |
| MDL Number | MFCD00006981 |
| SMILES | CC(CCC=C(C)C)C=O |
| Synonym | 2,6-dimethyl-5-heptenal,melonal,5-heptenal, 2,6-dimethyl,bergamal,2,6-dimethyl-5-hepten-1-al,2,6-dimethyl-5-heptanal,2,6-dimethylhept-5-en-1-al,fema no. 2389,2,6-dimethyl-2-hepten-7-al,2,6-dimethyl-5-heptenal natural |
| IUPAC Name | 2,6-dimethylhept-5-enal |
| InChI Key | YGFGZTXGYTUXBA-UHFFFAOYSA-N |
| Molecular Formula | C9H16O |