Product OPENEYE NAME: methyl nitrite
CAS Name: nitrous acid methyl ester
IUPAC NAME: methyl nitrite
SYSTEMATIC NAME: methyl nitrite
MOLECULAR FORMULA: CH3NO2
MOLECULAR WEIGHT: 61.04002
SMILES: CON=O
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Product OPENEYE NAME: (methyldisulfanyl)methane
CAS Name: (methyldisulfanyl)methane
IUPAC NAME: (methyldisulfanyl)methane
SYSTEMATIC NAME: (methyldisulfanyl)methane
MOLECULAR FORMULA: C2H6S2
MOLECULAR WEIGHT: 94.19904
SMILES: CSSC
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Product OPENEYE NAME: 3,3-dimethylbutan-1-ol
CAS Name: 3,3-dimethyl-1-butanol
IUPAC NAME: 3,3-dimethylbutan-1-ol
SYSTEMATIC NAME: 3,3-dimethylbutan-1-ol
MOLECULAR FORMULA: C6H14O
MOLECULAR WEIGHT: 102.17476
SMILES: CC(C)(C)CCO
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Product OPENEYE NAME: trimethyl(1-sulfanylethyl)ammonium
CAS Name: 1-mercaptoethyl(trimethyl)ammonium
IUPAC NAME: trimethyl(1-sulfanylethyl)azanium
SYSTEMATIC NAME: trimethyl(1-sulfanylethyl)azanium
MOLECULAR FORMULA: C5H14NS+
MOLECULAR WEIGHT: 120.23636
SMILES: CC([N+](C)(C)C)S
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Product OPENEYE NAME: 2,4-dimethylpentan-2-ol
CAS Name: 2,4-dimethyl-2-pentanol
IUPAC NAME: 2,4-dimethylpentan-2-ol
SYSTEMATIC NAME: 2,4-dimethylpentan-2-ol
MOLECULAR FORMULA: C7H16O
MOLECULAR WEIGHT: 116.20134
SMILES: CC(C)CC(C)(C)O
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Product OPENEYE NAME: [diethylamino(methoxy)phosphoryl] diethyl phosphate
CAS Name: phosphoric acid [diethylamino(methoxy)phosphoryl] diethyl ester
IUPAC NAME: [diethylamino(methoxy)phosphoryl] diethyl phosphate
SYSTEMATIC NAME: [diethylamino(methoxy)phosphoryl] diethyl phosphate
MOLECULAR FORMULA: C9H23NO6P2
MOLECULAR WEIGHT: 303.229542
SMILES: CCN(CC)P(=O)(OC)OP(=O)(OCC)OCC
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Product OPENEYE NAME: [dimethylamino(methoxy)phosphoryl] diethyl phosphate
CAS Name: phosphoric acid [dimethylamino(methoxy)phosphoryl] diethyl ester
IUPAC NAME: [dimethylamino(methoxy)phosphoryl] diethyl phosphate
SYSTEMATIC NAME: [dimethylamino(methoxy)phosphoryl] diethyl phosphate
MOLECULAR FORMULA: C7H19NO6P2
MOLECULAR WEIGHT: 275.176382
SMILES: CCOP(=O)(OCC)OP(=O)(N(C)C)OC
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Product OPENEYE NAME: 1,1-dimethylpropyl acetate
CAS Name: acetic acid 2-methylbutan-2-yl ester
IUPAC NAME: 2-methylbutan-2-yl acetate
SYSTEMATIC NAME: 2-methylbutan-2-yl ethanoate
MOLECULAR FORMULA: C7H14O2
MOLECULAR WEIGHT: 130.18486
SMILES: CCC(C)(C)OC(=O)C
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Product OPENEYE NAME: dibutyl sulfate
CAS Name: sulfuric acid dibutyl ester
IUPAC NAME: dibutyl sulfate
SYSTEMATIC NAME: dibutyl sulfate
MOLECULAR FORMULA: C8H18O4S
MOLECULAR WEIGHT: 210.29112
SMILES: CCCCOS(=O)(=O)OCCCC
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Product OPENEYE NAME: 2-methylhexan-2-ol
CAS Name: 2-methyl-2-hexanol
IUPAC NAME: 2-methylhexan-2-ol
SYSTEMATIC NAME: 2-methylhexan-2-ol
MOLECULAR FORMULA: C7H16O
MOLECULAR WEIGHT: 116.20134
SMILES: CCCCC(C)(C)O
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Product OPENEYE NAME: 2,2,2-trichloroethyl acetate
CAS Name: acetic acid 2,2,2-trichloroethyl ester
IUPAC NAME: 2,2,2-trichloroethyl acetate
SYSTEMATIC NAME: 2,2,2-tris(chloranyl)ethyl ethanoate
MOLECULAR FORMULA: C4H5Cl3O2
MOLECULAR WEIGHT: 191.4403
SMILES: CC(=O)OCC(Cl)(Cl)Cl
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Product OPENEYE NAME: 2-methylheptan-2-ol
CAS Name: 2-methyl-2-heptanol
IUPAC NAME: 2-methylheptan-2-ol
SYSTEMATIC NAME: 2-methylheptan-2-ol
MOLECULAR FORMULA: C8H18O
MOLECULAR WEIGHT: 130.22792
SMILES: CCCCCC(C)(C)O
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Product OPENEYE NAME: 2-methylpent-2-ene
CAS Name: 2-methyl-2-pentene
IUPAC NAME: 2-methylpent-2-ene
SYSTEMATIC NAME: 2-methylpent-2-ene
MOLECULAR FORMULA: C6H12
MOLECULAR WEIGHT: 84.15948
SMILES: CCC=C(C)C
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Product OPENEYE NAME: 3-methylbutanenitrile
CAS Name: 3-methylbutanenitrile
IUPAC NAME: 3-methylbutanenitrile
SYSTEMATIC NAME: 3-methylbutanenitrile
MOLECULAR FORMULA: C5H9N
MOLECULAR WEIGHT: 83.13166
SMILES: CC(C)CC#N
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