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3-Methyl-2-(N-methylanilino)-4-oxohexanenitrile
SpectraBase Compound ID HMXH0zFkmSn
InChI InChI=1S/C14H18N2O/c1-4-14(17)11(2)13(10-15)16(3)12-8-6-5-7-9-12/h5-9,11,13H,4H2,1-3H3
InChIKey VTVFBFBJYMCTJW-UHFFFAOYSA-N
Mol Weight 230.31 g/mol
Molecular Formula C14H18N2O
Exact Mass 230.141913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L5mhiLAvJyo
Name 3-Methyl-2-(N-methylanilino)-4-oxohexanenitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18N2O
InChI InChI=1S/C14H18N2O/c1-4-14(17)11(2)13(10-15)16(3)12-8-6-5-7-9-12/h5-9,11,13H,4H2,1-3H3
InChIKey VTVFBFBJYMCTJW-UHFFFAOYSA-N
Molecular Weight 230.311 g/mol
SMILES C(N(c1ccccc1)C)(C(C(=O)CC)C)C#N
SPLASH splash10-0002-0910000000-e20d0801d069570c418c
Source of Spectrum KC-0-2220-9
Synonyms 3-methyl-2-(methylanilino)-4-oxohexanenitrile
Wiley ID 781772