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2-(3-methylindol-1-yl)propanenitrile
SpectraBase Compound ID GNvK3D8mXsB
InChI InChI=1S/C12H12N2/c1-9-8-14(10(2)7-13)12-6-4-3-5-11(9)12/h3-6,8,10H,1-2H3
InChIKey YKQPUIVOBFMVLW-UHFFFAOYSA-N
Mol Weight 184.24 g/mol
Molecular Formula C12H12N2
Exact Mass 184.100048 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7cIJWrAd4Xq
Name 2-(3-methylindol-1-yl)propanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2
InChI InChI=1S/C12H12N2/c1-9-8-14(10(2)7-13)12-6-4-3-5-11(9)12/h3-6,8,10H,1-2H3
InChIKey YKQPUIVOBFMVLW-UHFFFAOYSA-N
Instrument Name VG 70-250S
Ionization Type EI
Literature Reference DOI 10.1016/j.jasms.2004.12.009
Molecular Weight 184.242 g/mol
SMILES c1cc2c(cc1)[n](cc2C)C(C)C#N
SPLASH splash10-00lr-1900000000-900ba1ec8088934a3991
Source of Spectrum A7-16-398-1
Wiley ID 1859266