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2-Methyl-2-(4-methyl-1H-indol-1-yl)propanenitrile
SpectraBase Compound ID 96xbwx4o27b
InChI InChI=1S/C13H14N2/c1-10-5-4-6-12-11(10)7-8-15(12)13(2,3)9-14/h4-8H,1-3H3
InChIKey AIOTZEASUSGKRD-UHFFFAOYSA-N
Mol Weight 198.27 g/mol
Molecular Formula C13H14N2
Exact Mass 198.115698 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JXULvbrb9j
Name 2-Methyl-2-(4-methyl-1H-indol-1-yl)propanenitrile
Appearance Brown liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2
InChI InChI=1S/C13H14N2/c1-10-5-4-6-12-11(10)7-8-15(12)13(2,3)9-14/h4-8H,1-3H3
InChIKey AIOTZEASUSGKRD-UHFFFAOYSA-N
Instrument Name SHIMADZU GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00808
Molecular Weight 198.269 g/mol
Reported Formula C13H14N2
SMILES CC(C#N)(C)[n]1ccc2c1cccc2C
SPLASH splash10-001i-1900000000-61a57ab797860b3b182e
Source of Spectrum JOC-86-8396-3q'a
Wiley ID 1867827