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2-(3,4-DIMETHOXY-PHENYL)-3-METHYL-2-(1-METHYL-ETHYL)-BUTANE-NITRILE;IMPURITY-#2
SpectraBase Compound ID IlfFyQLcItj
InChI InChI=1S/C16H23NO2/c1-11(2)16(10-17,12(3)4)13-7-8-14(18-5)15(9-13)19-6/h7-9,11-12H,1-6H3
InChIKey VWPDXOUCSSNGRV-UHFFFAOYSA-N
Mol Weight 261.36 g/mol
Molecular Formula C16H23NO2
Exact Mass 261.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HjKdXSB3ZhY
Name 2-(3,4-dimethoxyphenyl)-2-isopropyl-3-methyl-butanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO2
InChI InChI=1S/C16H23NO2/c1-11(2)16(10-17,12(3)4)13-7-8-14(18-5)15(9-13)19-6/h7-9,11-12H,1-6H3
InChIKey VWPDXOUCSSNGRV-UHFFFAOYSA-N
Molecular Weight 261.365 g/mol
SMILES COc1cc(ccc1OC)C(C(C)C)(C#N)C(C)C
SPLASH splash10-014i-3890000000-0d05508a6039f8a262cf
Synonyms 2-(3,4-dimethoxyphenyl)-2-isopropyl-3-methyl-butyronitrile 2-(3,4-dimethoxyphenyl)-3-methyl-2-propan-2-yl-butanenitrile
Wiley ID 1471816