Carbonyl compounds
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2-Ethoxy-1-naphthaldehyde 98.0+%, TCI America™
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CAS: 19523-57-0 Molecular Formula: C13H12O2 Molecular Weight (g/mol): 200.24 MDL Number: MFCD00046427 InChI Key: IMNKQTWVJHODOS-UHFFFAOYSA-N Synonym: 2-ethoxy-1-naphthaldehyde,1-naphthalenecarboxaldehyde, 2-ethoxy,2-ethoxy-1-naphthalenecarboxaldehyde,1-naphthaldehyde, 2-ethoxy,1-naphthalenecarboxaldehyde,2-ethoxy,2-ethoxynaphthalenecarbaldehyde,2-athoxy-naphthal,acmc-1bs4w,2-ethoxy-1-naphthalenecarbaldehyde,2-ethoxy-naphthalene-1-carbaldehyde PubChem CID: 88099 IUPAC Name: 2-ethoxynaphthalene-1-carbaldehyde SMILES: CCOC1=CC=C2C=CC=CC2=C1C=O
| PubChem CID | 88099 |
|---|---|
| CAS | 19523-57-0 |
| Molecular Weight (g/mol) | 200.24 |
| MDL Number | MFCD00046427 |
| SMILES | CCOC1=CC=C2C=CC=CC2=C1C=O |
| Synonym | 2-ethoxy-1-naphthaldehyde,1-naphthalenecarboxaldehyde, 2-ethoxy,2-ethoxy-1-naphthalenecarboxaldehyde,1-naphthaldehyde, 2-ethoxy,1-naphthalenecarboxaldehyde,2-ethoxy,2-ethoxynaphthalenecarbaldehyde,2-athoxy-naphthal,acmc-1bs4w,2-ethoxy-1-naphthalenecarbaldehyde,2-ethoxy-naphthalene-1-carbaldehyde |
| IUPAC Name | 2-ethoxynaphthalene-1-carbaldehyde |
| InChI Key | IMNKQTWVJHODOS-UHFFFAOYSA-N |
| Molecular Formula | C13H12O2 |
1,2-Indandione 98.0+%, TCI America™
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CAS: 16214-27-0 Molecular Formula: C9H6O2 Molecular Weight (g/mol): 146.145 MDL Number: MFCD00463378 InChI Key: WFFZGYRTVIPBFN-UHFFFAOYSA-N Synonym: 1h-indene-1,2 3h-dione,1,2-indanedione,indan-1,2-dione,1,2-indandione,indandione,2,3-dihydro-1h-indene-1,2-dione,indane dione,acmc-20a7vb,d01xgp PubChem CID: 123358 IUPAC Name: 3H-indene-1,2-dione SMILES: C1C2=CC=CC=C2C(=O)C1=O
| PubChem CID | 123358 |
|---|---|
| CAS | 16214-27-0 |
| Molecular Weight (g/mol) | 146.145 |
| MDL Number | MFCD00463378 |
| SMILES | C1C2=CC=CC=C2C(=O)C1=O |
| Synonym | 1h-indene-1,2 3h-dione,1,2-indanedione,indan-1,2-dione,1,2-indandione,indandione,2,3-dihydro-1h-indene-1,2-dione,indane dione,acmc-20a7vb,d01xgp |
| IUPAC Name | 3H-indene-1,2-dione |
| InChI Key | WFFZGYRTVIPBFN-UHFFFAOYSA-N |
| Molecular Formula | C9H6O2 |
Dimethyl 1,4-Cyclohexanedione-2,5-dicarboxylate 98.0+%, TCI America™
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CAS: 6289-46-9 Molecular Formula: C10H12O6 Molecular Weight (g/mol): 228.20 MDL Number: MFCD00001607 InChI Key: MHKKFFHWMKEBDW-UHFFFAOYNA-N Synonym: dimethyl succinylsuccinate,dimethyl 1,4-cyclohexanedione-2,5-dicarboxylate,succinosuccinic acid, dimethyl ester,dmss,dimethyl succinylosuccinate,dimethyl 2,5-dioxo-1,4-cyclohexanedicarboxylate,dimethyl succinylo succinate,1,4-cyclohexanedicarboxylic acid, 2,5-dioxo-, dimethyl ester,2,5-dioxo-1,4-cyclohexanedicarboxylic acid dimethyl ester,1,4-cyclohexanedicarboxylic acid, 2,5-dioxo-, 1,4-dimethyl ester PubChem CID: 94866 IUPAC Name: 1,4-dimethyl 2,5-dioxocyclohexane-1,4-dicarboxylate SMILES: COC(=O)C1CC(=O)C(CC1=O)C(=O)OC
| PubChem CID | 94866 |
|---|---|
| CAS | 6289-46-9 |
| Molecular Weight (g/mol) | 228.20 |
| MDL Number | MFCD00001607 |
| SMILES | COC(=O)C1CC(=O)C(CC1=O)C(=O)OC |
| Synonym | dimethyl succinylsuccinate,dimethyl 1,4-cyclohexanedione-2,5-dicarboxylate,succinosuccinic acid, dimethyl ester,dmss,dimethyl succinylosuccinate,dimethyl 2,5-dioxo-1,4-cyclohexanedicarboxylate,dimethyl succinylo succinate,1,4-cyclohexanedicarboxylic acid, 2,5-dioxo-, dimethyl ester,2,5-dioxo-1,4-cyclohexanedicarboxylic acid dimethyl ester,1,4-cyclohexanedicarboxylic acid, 2,5-dioxo-, 1,4-dimethyl ester |
| IUPAC Name | 1,4-dimethyl 2,5-dioxocyclohexane-1,4-dicarboxylate |
| InChI Key | MHKKFFHWMKEBDW-UHFFFAOYNA-N |
| Molecular Formula | C10H12O6 |
1-Hydroxyanthraquinone 98.0+%, TCI America™
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CAS: 129-43-1 Molecular Formula: C14H8O3 Molecular Weight (g/mol): 224.215 MDL Number: MFCD00058946 InChI Key: BTLXPCBPYBNQNR-UHFFFAOYSA-N PubChem CID: 8512 ChEBI: CHEBI:28877 IUPAC Name: 1-hydroxyanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)O
| PubChem CID | 8512 |
|---|---|
| CAS | 129-43-1 |
| Molecular Weight (g/mol) | 224.215 |
| ChEBI | CHEBI:28877 |
| MDL Number | MFCD00058946 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)O |
| IUPAC Name | 1-hydroxyanthracene-9,10-dione |
| InChI Key | BTLXPCBPYBNQNR-UHFFFAOYSA-N |
| Molecular Formula | C14H8O3 |
2-Furoyltrifluoroacetone, TCI America™
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CAS: 326-90-9 Molecular Formula: C8H5F3O3 Molecular Weight (g/mol): 206.12 MDL Number: MFCD00020935 InChI Key: OWLPCALGCHDBCN-UHFFFAOYSA-N Synonym: 4,4,4-trifluoro-1-furan-2-yl butane-1,3-dione,2-furoyltrifluoroacetone,furoyltrifluoroacetone,4,4,4-trifluoro-1-2-furyl-1,3-butanedione,perfluoroacetyl 2-furoyl methane,furonyltrifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-furanyl,4,4,4-trifluoro-1-2-furyl butane-1,3-dione,2-furoyl trifluoro acetone,4,4,4-trifluoro-1-2-furanyl-1,3-butanedione PubChem CID: 67594 IUPAC Name: 4,4,4-trifluoro-1-(furan-2-yl)butane-1,3-dione SMILES: FC(F)(F)C(=O)CC(=O)C1=CC=CO1
| PubChem CID | 67594 |
|---|---|
| CAS | 326-90-9 |
| Molecular Weight (g/mol) | 206.12 |
| MDL Number | MFCD00020935 |
| SMILES | FC(F)(F)C(=O)CC(=O)C1=CC=CO1 |
| Synonym | 4,4,4-trifluoro-1-furan-2-yl butane-1,3-dione,2-furoyltrifluoroacetone,furoyltrifluoroacetone,4,4,4-trifluoro-1-2-furyl-1,3-butanedione,perfluoroacetyl 2-furoyl methane,furonyltrifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-furanyl,4,4,4-trifluoro-1-2-furyl butane-1,3-dione,2-furoyl trifluoro acetone,4,4,4-trifluoro-1-2-furanyl-1,3-butanedione |
| IUPAC Name | 4,4,4-trifluoro-1-(furan-2-yl)butane-1,3-dione |
| InChI Key | OWLPCALGCHDBCN-UHFFFAOYSA-N |
| Molecular Formula | C8H5F3O3 |
2-(Dicyanomethylene)indan-1,3-dione 98.0+%, TCI America™
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CAS: 90522-66-0 Molecular Formula: C12H4N2O2 Molecular Weight (g/mol): 208.176 MDL Number: MFCD00051930 InChI Key: WQFLMIPTYDGFOB-UHFFFAOYSA-N PubChem CID: 542782 IUPAC Name: 2-(1,3-dioxoinden-2-ylidene)propanedinitrile SMILES: C1=CC=C2C(=C1)C(=O)C(=C(C#N)C#N)C2=O
| PubChem CID | 542782 |
|---|---|
| CAS | 90522-66-0 |
| Molecular Weight (g/mol) | 208.176 |
| MDL Number | MFCD00051930 |
| SMILES | C1=CC=C2C(=C1)C(=O)C(=C(C#N)C#N)C2=O |
| IUPAC Name | 2-(1,3-dioxoinden-2-ylidene)propanedinitrile |
| InChI Key | WQFLMIPTYDGFOB-UHFFFAOYSA-N |
| Molecular Formula | C12H4N2O2 |
alpha-iso-Methylionone 70.0+%, TCI America™
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CAS: 127-51-5 Molecular Formula: C14H22O Molecular Weight (g/mol): 206.33 MDL Number: MFCD00034582 InChI Key: JRJBVWJSTHECJK-LUAWRHEFNA-N Synonym: alpha-Isomethylionone, 3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one PubChem CID: 5372174 IUPAC Name: (3Z)-3-methyl-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one SMILES: CC(=O)C(\C)=C/C1C(C)=CCCC1(C)C
| PubChem CID | 5372174 |
|---|---|
| CAS | 127-51-5 |
| Molecular Weight (g/mol) | 206.33 |
| MDL Number | MFCD00034582 |
| SMILES | CC(=O)C(\C)=C/C1C(C)=CCCC1(C)C |
| Synonym | alpha-Isomethylionone, 3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one |
| IUPAC Name | (3Z)-3-methyl-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one |
| InChI Key | JRJBVWJSTHECJK-LUAWRHEFNA-N |
| Molecular Formula | C14H22O |
Ethyl 4,4,4-Trifluoroacetoacetate 98.0+%, TCI America™
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CAS: 372-31-6 Molecular Formula: C6H7F3O3 Molecular Weight (g/mol): 184.114 MDL Number: MFCD00000424 InChI Key: OCJKUQIPRNZDTK-UHFFFAOYSA-N Synonym: ethyl 4,4,4-trifluoroacetoacetate,ethyl trifluoroacetoacetate,butanoic acid, 4,4,4-trifluoro-3-oxo-, ethyl ester,4,4,4-trifluoro-3-oxobutanoic acid ethyl ester,ethyl trifluoroacetyl acetate,etfaa,4,4,4-trifluoroacetoacetic acid ethyl ester,ethyl-4,4,4-trifluoroacetoacetate,trifluoroacetoacetic acid ethyl ester,4,4,4-trifluoro-3-oxo-butyric acid ethyl ester PubChem CID: 67793 IUPAC Name: ethyl 4,4,4-trifluoro-3-oxobutanoate SMILES: CCOC(=O)CC(=O)C(F)(F)F
| PubChem CID | 67793 |
|---|---|
| CAS | 372-31-6 |
| Molecular Weight (g/mol) | 184.114 |
| MDL Number | MFCD00000424 |
| SMILES | CCOC(=O)CC(=O)C(F)(F)F |
| Synonym | ethyl 4,4,4-trifluoroacetoacetate,ethyl trifluoroacetoacetate,butanoic acid, 4,4,4-trifluoro-3-oxo-, ethyl ester,4,4,4-trifluoro-3-oxobutanoic acid ethyl ester,ethyl trifluoroacetyl acetate,etfaa,4,4,4-trifluoroacetoacetic acid ethyl ester,ethyl-4,4,4-trifluoroacetoacetate,trifluoroacetoacetic acid ethyl ester,4,4,4-trifluoro-3-oxo-butyric acid ethyl ester |
| IUPAC Name | ethyl 4,4,4-trifluoro-3-oxobutanoate |
| InChI Key | OCJKUQIPRNZDTK-UHFFFAOYSA-N |
| Molecular Formula | C6H7F3O3 |
2',4',6'-Trihydroxy-2-phenylacetophenone 96.0+%, TCI America™
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CAS: 727-71-9 Molecular Formula: C14H12O4 Molecular Weight (g/mol): 244.25 MDL Number: MFCD00205539 InChI Key: SLHBRIIHMDJIBT-UHFFFAOYSA-N Synonym: Benzyl 2,4,6-Trihydroxyphenyl Ketone PubChem CID: 689111 IUPAC Name: 2-phenyl-1-(2,4,6-trihydroxyphenyl)ethan-1-one SMILES: OC1=CC(O)=C(C(=O)CC2=CC=CC=C2)C(O)=C1
| PubChem CID | 689111 |
|---|---|
| CAS | 727-71-9 |
| Molecular Weight (g/mol) | 244.25 |
| MDL Number | MFCD00205539 |
| SMILES | OC1=CC(O)=C(C(=O)CC2=CC=CC=C2)C(O)=C1 |
| Synonym | Benzyl 2,4,6-Trihydroxyphenyl Ketone |
| IUPAC Name | 2-phenyl-1-(2,4,6-trihydroxyphenyl)ethan-1-one |
| InChI Key | SLHBRIIHMDJIBT-UHFFFAOYSA-N |
| Molecular Formula | C14H12O4 |
4'-Dimethylaminoacetophenone 98.0+%, TCI America™
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CAS: 2124-31-4 Molecular Formula: C10H13NO Molecular Weight (g/mol): 163.22 MDL Number: MFCD00017246 InChI Key: HUDYANRNMZDQGA-UHFFFAOYSA-N PubChem CID: 75037 IUPAC Name: 1-[4-(dimethylamino)phenyl]ethan-1-one SMILES: CN(C)C1=CC=C(C=C1)C(C)=O
| PubChem CID | 75037 |
|---|---|
| CAS | 2124-31-4 |
| Molecular Weight (g/mol) | 163.22 |
| MDL Number | MFCD00017246 |
| SMILES | CN(C)C1=CC=C(C=C1)C(C)=O |
| IUPAC Name | 1-[4-(dimethylamino)phenyl]ethan-1-one |
| InChI Key | HUDYANRNMZDQGA-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO |
4'-Chloro-2,2,2-trifluoroacetophenone 97.0+%, TCI America™
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CAS: 321-37-9 Molecular Formula: C8H4ClF3O Molecular Weight (g/mol): 208.564 MDL Number: MFCD00018686 InChI Key: DYPQUENOGZXOGE-UHFFFAOYSA-N PubChem CID: 67578 IUPAC Name: 1-(4-chlorophenyl)-2,2,2-trifluoroethanone SMILES: C1=CC(=CC=C1C(=O)C(F)(F)F)Cl
| PubChem CID | 67578 |
|---|---|
| CAS | 321-37-9 |
| Molecular Weight (g/mol) | 208.564 |
| MDL Number | MFCD00018686 |
| SMILES | C1=CC(=CC=C1C(=O)C(F)(F)F)Cl |
| IUPAC Name | 1-(4-chlorophenyl)-2,2,2-trifluoroethanone |
| InChI Key | DYPQUENOGZXOGE-UHFFFAOYSA-N |
| Molecular Formula | C8H4ClF3O |
1-Octen-3-one 95.0+%, TCI America™
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CAS: 4312-99-6 Molecular Formula: C8H14O Molecular Weight (g/mol): 126.199 MDL Number: MFCD00036558 InChI Key: KLTVSWGXIAYTHO-UHFFFAOYSA-N Synonym: 1-octen-3-one,vinyl amyl ketone,amyl vinyl ketone,pentyl vinyl ketone,unii-7lt7z4q9xr,1-octene-3-one,fema no. 3515,7lt7z4q9xr,n-pentyl vinyl ketone,octen-3-one, 1 PubChem CID: 61346 IUPAC Name: oct-1-en-3-one SMILES: CCCCCC(=O)C=C
| PubChem CID | 61346 |
|---|---|
| CAS | 4312-99-6 |
| Molecular Weight (g/mol) | 126.199 |
| MDL Number | MFCD00036558 |
| SMILES | CCCCCC(=O)C=C |
| Synonym | 1-octen-3-one,vinyl amyl ketone,amyl vinyl ketone,pentyl vinyl ketone,unii-7lt7z4q9xr,1-octene-3-one,fema no. 3515,7lt7z4q9xr,n-pentyl vinyl ketone,octen-3-one, 1 |
| IUPAC Name | oct-1-en-3-one |
| InChI Key | KLTVSWGXIAYTHO-UHFFFAOYSA-N |
| Molecular Formula | C8H14O |
Ethyl 2-Benzylacetoacetate 97.0+%, TCI America™
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CAS: 620-79-1 Molecular Formula: C13H16O3 Molecular Weight (g/mol): 220.268 MDL Number: MFCD00009156 InChI Key: XDWQYMXQMNUWID-UHFFFAOYSA-N Synonym: ethyl 2-benzylacetoacetate,ethyl 2-acetyl-3-phenylpropionate,ethyl benzyl acetoacetate,ethyl alpha-benzylacetoacetate,2-benzylacetoacetic acid ethyl ester,ethyl .alpha.-benzylacetoacetate,2-benzylacetoacetate,ethyl 3-oxo-2-benzylbutanoate,ethyl alpha-acetylhydrocinnamate,ethyl benzylacetoacetate PubChem CID: 246929 IUPAC Name: ethyl 2-benzyl-3-oxobutanoate SMILES: CCOC(=O)C(CC1=CC=CC=C1)C(=O)C
| PubChem CID | 246929 |
|---|---|
| CAS | 620-79-1 |
| Molecular Weight (g/mol) | 220.268 |
| MDL Number | MFCD00009156 |
| SMILES | CCOC(=O)C(CC1=CC=CC=C1)C(=O)C |
| Synonym | ethyl 2-benzylacetoacetate,ethyl 2-acetyl-3-phenylpropionate,ethyl benzyl acetoacetate,ethyl alpha-benzylacetoacetate,2-benzylacetoacetic acid ethyl ester,ethyl .alpha.-benzylacetoacetate,2-benzylacetoacetate,ethyl 3-oxo-2-benzylbutanoate,ethyl alpha-acetylhydrocinnamate,ethyl benzylacetoacetate |
| IUPAC Name | ethyl 2-benzyl-3-oxobutanoate |
| InChI Key | XDWQYMXQMNUWID-UHFFFAOYSA-N |
| Molecular Formula | C13H16O3 |
2'-Hydroxy-4',6'-dimethoxy-2-(4-methoxyphenyl)acetophenone 98.0+%, TCI America™
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CAS: 39604-68-7 Molecular Formula: C17H18O5 Molecular Weight (g/mol): 302.33 MDL Number: MFCD03934798 InChI Key: ROJOJPXRGHLGTC-UHFFFAOYSA-N Synonym: 2-Hydroxy-4,6-dimethoxyphenyl 4-Methoxybenzyl Ketone PubChem CID: 689039 IUPAC Name: 1-(2-hydroxy-4,6-dimethoxyphenyl)-2-(4-methoxyphenyl)ethan-1-one SMILES: COC1=CC=C(CC(=O)C2=C(O)C=C(OC)C=C2OC)C=C1
| PubChem CID | 689039 |
|---|---|
| CAS | 39604-68-7 |
| Molecular Weight (g/mol) | 302.33 |
| MDL Number | MFCD03934798 |
| SMILES | COC1=CC=C(CC(=O)C2=C(O)C=C(OC)C=C2OC)C=C1 |
| Synonym | 2-Hydroxy-4,6-dimethoxyphenyl 4-Methoxybenzyl Ketone |
| IUPAC Name | 1-(2-hydroxy-4,6-dimethoxyphenyl)-2-(4-methoxyphenyl)ethan-1-one |
| InChI Key | ROJOJPXRGHLGTC-UHFFFAOYSA-N |
| Molecular Formula | C17H18O5 |
4,4,4-Trifluoro-1-(4-methoxyphenyl)-1,3-butanedione 98.0+%, TCI America™
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CAS: 15191-68-1 Molecular Formula: C11H9F3O3 Molecular Weight (g/mol): 246.185 MDL Number: MFCD03238723 InChI Key: NNEIYSHJFCLFES-UHFFFAOYSA-N Synonym: 4,4,4-trifluoro-1-4-methoxyphenyl butane-1,3-dione,4,4,4-trifluoro-1-4-methoxyphenyl-1,3-butanedione,2,4-butanedione, 1,1,1-trifluoro-4-4-methoxyphenyl,4-methoxybenzoyl-1,1,1-trifluoroacetone,1,3-butanedione,4,4,4-trifluoro-1-4-methoxyphenyl,tos-bb-0662,p-methoxybenzoyltrifluoroacetone,1-p-methoxybenzoyl-3,3,3-trifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-4-methoxyphenyl,1-4-methoxy-phenyl-4,4,4-trifluoro-butane-1,3-dione PubChem CID: 139903 IUPAC Name: 4,4,4-trifluoro-1-(4-methoxyphenyl)butane-1,3-dione SMILES: COC1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F
| PubChem CID | 139903 |
|---|---|
| CAS | 15191-68-1 |
| Molecular Weight (g/mol) | 246.185 |
| MDL Number | MFCD03238723 |
| SMILES | COC1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F |
| Synonym | 4,4,4-trifluoro-1-4-methoxyphenyl butane-1,3-dione,4,4,4-trifluoro-1-4-methoxyphenyl-1,3-butanedione,2,4-butanedione, 1,1,1-trifluoro-4-4-methoxyphenyl,4-methoxybenzoyl-1,1,1-trifluoroacetone,1,3-butanedione,4,4,4-trifluoro-1-4-methoxyphenyl,tos-bb-0662,p-methoxybenzoyltrifluoroacetone,1-p-methoxybenzoyl-3,3,3-trifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-4-methoxyphenyl,1-4-methoxy-phenyl-4,4,4-trifluoro-butane-1,3-dione |
| IUPAC Name | 4,4,4-trifluoro-1-(4-methoxyphenyl)butane-1,3-dione |
| InChI Key | NNEIYSHJFCLFES-UHFFFAOYSA-N |
| Molecular Formula | C11H9F3O3 |