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Filtered Search Results
Reserpine, SPEX CertiPrep™
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CAS: 50-55-5 Molecular Formula: C33H40N2O9 Molecular Weight (g/mol): 608.688 InChI Key: QEVHRUUCFGRFIF-MDEJGZGSSA-N PubChem CID: 5770 ChEBI: CHEBI:28487 IUPAC Name: methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate SMILES: COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC
| PubChem CID | 5770 |
|---|---|
| CAS | 50-55-5 |
| Molecular Weight (g/mol) | 608.688 |
| ChEBI | CHEBI:28487 |
| SMILES | COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC |
| IUPAC Name | methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate |
| InChI Key | QEVHRUUCFGRFIF-MDEJGZGSSA-N |
| Molecular Formula | C33H40N2O9 |
Prowl (Pendimethalin), SPEX CertiPrep™
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CAS: 40487-42-1 Molecular Formula: C13H19N3O4 Molecular Weight (g/mol): 281.312 InChI Key: CHIFOSRWCNZCFN-UHFFFAOYSA-N PubChem CID: 38479 ChEBI: CHEBI:83569 IUPAC Name: 3,4-dimethyl-2,6-dinitro-N-pentan-3-ylaniline SMILES: CCC(CC)NC1=C(C=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-]
| PubChem CID | 38479 |
|---|---|
| CAS | 40487-42-1 |
| Molecular Weight (g/mol) | 281.312 |
| ChEBI | CHEBI:83569 |
| SMILES | CCC(CC)NC1=C(C=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-] |
| IUPAC Name | 3,4-dimethyl-2,6-dinitro-N-pentan-3-ylaniline |
| InChI Key | CHIFOSRWCNZCFN-UHFFFAOYSA-N |
| Molecular Formula | C13H19N3O4 |
Propylene Oxide, SPEX CertiPrep™
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CAS: 75-56-9 Molecular Formula: C3H6O Molecular Weight (g/mol): 58.08 MDL Number: MFCD00005126 InChI Key: GOOHAUXETOMSMM-UHFFFAOYNA-N PubChem CID: 6378 ChEBI: CHEBI:38685 IUPAC Name: 2-methyloxirane SMILES: CC1CO1
| PubChem CID | 6378 |
|---|---|
| CAS | 75-56-9 |
| Molecular Weight (g/mol) | 58.08 |
| ChEBI | CHEBI:38685 |
| MDL Number | MFCD00005126 |
| SMILES | CC1CO1 |
| IUPAC Name | 2-methyloxirane |
| InChI Key | GOOHAUXETOMSMM-UHFFFAOYNA-N |
| Molecular Formula | C3H6O |
1-Propanol, SPEX CertiPrep™
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CAS: 71-23-8 Molecular Formula: C3H8O Molecular Weight (g/mol): 60.10 MDL Number: MFCD00002941 InChI Key: BDERNNFJNOPAEC-UHFFFAOYSA-N PubChem CID: 1031 ChEBI: CHEBI:28831 IUPAC Name: propan-1-ol SMILES: CCCO
| PubChem CID | 1031 |
|---|---|
| CAS | 71-23-8 |
| Molecular Weight (g/mol) | 60.10 |
| ChEBI | CHEBI:28831 |
| MDL Number | MFCD00002941 |
| SMILES | CCCO |
| IUPAC Name | propan-1-ol |
| InChI Key | BDERNNFJNOPAEC-UHFFFAOYSA-N |
| Molecular Formula | C3H8O |
Propane, SPEX CertiPrep™
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CAS: 74-98-6 Molecular Formula: C3H8 Molecular Weight (g/mol): 44.097 InChI Key: ATUOYWHBWRKTHZ-UHFFFAOYSA-N PubChem CID: 6334 ChEBI: CHEBI:32879 IUPAC Name: propane SMILES: CCC
| PubChem CID | 6334 |
|---|---|
| CAS | 74-98-6 |
| Molecular Weight (g/mol) | 44.097 |
| ChEBI | CHEBI:32879 |
| SMILES | CCC |
| IUPAC Name | propane |
| InChI Key | ATUOYWHBWRKTHZ-UHFFFAOYSA-N |
| Molecular Formula | C3H8 |
Prometon, SPEX CertiPrep™
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CAS: 1610-18-0 Molecular Formula: C10H19N5O Molecular Weight (g/mol): 225.296 InChI Key: ISEUFVQQFVOBCY-UHFFFAOYSA-N PubChem CID: 4928 ChEBI: CHEBI:34934 IUPAC Name: 6-methoxy-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine SMILES: CC(C)NC1=NC(=NC(=N1)OC)NC(C)C
| PubChem CID | 4928 |
|---|---|
| CAS | 1610-18-0 |
| Molecular Weight (g/mol) | 225.296 |
| ChEBI | CHEBI:34934 |
| SMILES | CC(C)NC1=NC(=NC(=N1)OC)NC(C)C |
| IUPAC Name | 6-methoxy-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine |
| InChI Key | ISEUFVQQFVOBCY-UHFFFAOYSA-N |
| Molecular Formula | C10H19N5O |
p-Terphenyl-D14, SPEX CertiPrep™
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CAS: 1718-51-0 Molecular Formula: C18H14 Molecular Weight (g/mol): 244.395 InChI Key: XJKSTNDFUHDPQJ-WZAAGXFHSA-N PubChem CID: 123128 IUPAC Name: 1,2,3,4,5-pentadeuterio-6-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzene SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3
| PubChem CID | 123128 |
|---|---|
| CAS | 1718-51-0 |
| Molecular Weight (g/mol) | 244.395 |
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3 |
| IUPAC Name | 1,2,3,4,5-pentadeuterio-6-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzene |
| InChI Key | XJKSTNDFUHDPQJ-WZAAGXFHSA-N |
| Molecular Formula | C18H14 |
Styrene, SPEX CertiPrep™
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CAS: 100-42-5 Molecular Formula: C8H8 Molecular Weight (g/mol): 104.15 MDL Number: MFCD00008612,MFCD00084450 InChI Key: PPBRXRYQALVLMV-UHFFFAOYSA-N PubChem CID: 7501 ChEBI: CHEBI:27452 IUPAC Name: ethenylbenzene SMILES: C=CC1=CC=CC=C1
| PubChem CID | 7501 |
|---|---|
| CAS | 100-42-5 |
| Molecular Weight (g/mol) | 104.15 |
| ChEBI | CHEBI:27452 |
| MDL Number | MFCD00008612,MFCD00084450 |
| SMILES | C=CC1=CC=CC=C1 |
| IUPAC Name | ethenylbenzene |
| InChI Key | PPBRXRYQALVLMV-UHFFFAOYSA-N |
| Molecular Formula | C8H8 |
Chloroethane, SPEX CertiPrep™
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CAS: 75-00-3 Molecular Formula: C2H5Cl Molecular Weight (g/mol): 64.512 InChI Key: HRYZWHHZPQKTII-UHFFFAOYSA-N PubChem CID: 6337 ChEBI: CHEBI:47554 IUPAC Name: chloroethane SMILES: CCCl
| PubChem CID | 6337 |
|---|---|
| CAS | 75-00-3 |
| Molecular Weight (g/mol) | 64.512 |
| ChEBI | CHEBI:47554 |
| SMILES | CCCl |
| IUPAC Name | chloroethane |
| InChI Key | HRYZWHHZPQKTII-UHFFFAOYSA-N |
| Molecular Formula | C2H5Cl |
1,2-Dimethoxyethane, SPEX CertiPrep™
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CAS: 110-71-4 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.122 InChI Key: XTHFKEDIFFGKHM-UHFFFAOYSA-N PubChem CID: 8071 ChEBI: CHEBI:42263 IUPAC Name: 1,2-dimethoxyethane SMILES: COCCOC
| PubChem CID | 8071 |
|---|---|
| CAS | 110-71-4 |
| Molecular Weight (g/mol) | 90.122 |
| ChEBI | CHEBI:42263 |
| SMILES | COCCOC |
| IUPAC Name | 1,2-dimethoxyethane |
| InChI Key | XTHFKEDIFFGKHM-UHFFFAOYSA-N |
| Molecular Formula | C4H10O2 |
Alachlor, SPEX CertiPrep™
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CAS: 15972-60-8 Molecular Formula: C14H20ClNO2 Molecular Weight (g/mol): 269.769 InChI Key: XCSGPAVHZFQHGE-UHFFFAOYSA-N PubChem CID: 2078 ChEBI: CHEBI:2533 IUPAC Name: 2-chloro-N-(2,6-diethylphenyl)-N-(methoxymethyl)acetamide SMILES: CCC1=C(C(=CC=C1)CC)N(COC)C(=O)CCl
| PubChem CID | 2078 |
|---|---|
| CAS | 15972-60-8 |
| Molecular Weight (g/mol) | 269.769 |
| ChEBI | CHEBI:2533 |
| SMILES | CCC1=C(C(=CC=C1)CC)N(COC)C(=O)CCl |
| IUPAC Name | 2-chloro-N-(2,6-diethylphenyl)-N-(methoxymethyl)acetamide |
| InChI Key | XCSGPAVHZFQHGE-UHFFFAOYSA-N |
| Molecular Formula | C14H20ClNO2 |
bis(2-Ethylhexyl)phthalate, SPEX CertiPrep™
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CAS: 117-81-7 Molecular Formula: C24H38O4 Molecular Weight (g/mol): 390.564 InChI Key: BJQHLKABXJIVAM-UHFFFAOYSA-N PubChem CID: 8343 ChEBI: CHEBI:17747 IUPAC Name: bis(2-ethylhexyl) benzene-1,2-dicarboxylate SMILES: CCCCC(CC)COC(=O)C1=CC=CC=C1C(=O)OCC(CC)CCCC
| PubChem CID | 8343 |
|---|---|
| CAS | 117-81-7 |
| Molecular Weight (g/mol) | 390.564 |
| ChEBI | CHEBI:17747 |
| SMILES | CCCCC(CC)COC(=O)C1=CC=CC=C1C(=O)OCC(CC)CCCC |
| IUPAC Name | bis(2-ethylhexyl) benzene-1,2-dicarboxylate |
| InChI Key | BJQHLKABXJIVAM-UHFFFAOYSA-N |
| Molecular Formula | C24H38O4 |
Formaldehyde, SPEX CertiPrep™
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CAS: 50-00-0 Molecular Formula: CH2O Molecular Weight (g/mol): 30.03 MDL Number: MFCD00003274 InChI Key: WSFSSNUMVMOOMR-UHFFFAOYSA-N PubChem CID: 712 ChEBI: CHEBI:16842 IUPAC Name: formaldehyde SMILES: C=O
| PubChem CID | 712 |
|---|---|
| CAS | 50-00-0 |
| Molecular Weight (g/mol) | 30.03 |
| ChEBI | CHEBI:16842 |
| MDL Number | MFCD00003274 |
| SMILES | C=O |
| IUPAC Name | formaldehyde |
| InChI Key | WSFSSNUMVMOOMR-UHFFFAOYSA-N |
| Molecular Formula | CH2O |
Ethylene Glycol, SPEX CertiPrep™
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CAS: 107-21-1 Molecular Formula: C2H6O2 Molecular Weight (g/mol): 62.068 InChI Key: LYCAIKOWRPUZTN-UHFFFAOYSA-N PubChem CID: 174 ChEBI: CHEBI:30742 IUPAC Name: ethane-1,2-diol SMILES: C(CO)O
| PubChem CID | 174 |
|---|---|
| CAS | 107-21-1 |
| Molecular Weight (g/mol) | 62.068 |
| ChEBI | CHEBI:30742 |
| SMILES | C(CO)O |
| IUPAC Name | ethane-1,2-diol |
| InChI Key | LYCAIKOWRPUZTN-UHFFFAOYSA-N |
| Molecular Formula | C2H6O2 |
n-Hexane, SPEX CertiPrep™
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CAS: 110-54-3 Molecular Formula: C6H14 Molecular Weight (g/mol): 86.18 MDL Number: MFCD02179311 InChI Key: VLKZOEOYAKHREP-UHFFFAOYSA-N PubChem CID: 8058 ChEBI: CHEBI:29021 IUPAC Name: hexane SMILES: CCCCCC
| PubChem CID | 8058 |
|---|---|
| CAS | 110-54-3 |
| Molecular Weight (g/mol) | 86.18 |
| ChEBI | CHEBI:29021 |
| MDL Number | MFCD02179311 |
| SMILES | CCCCCC |
| IUPAC Name | hexane |
| InChI Key | VLKZOEOYAKHREP-UHFFFAOYSA-N |
| Molecular Formula | C6H14 |