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2-(1-pentyl-1H-indol-3-yl)acetonitrile
SpectraBase Compound ID 1685pCHYcdt
InChI InChI=1S/C15H18N2/c1-2-3-6-11-17-12-13(9-10-16)14-7-4-5-8-15(14)17/h4-5,7-8,12H,2-3,6,9,11H2,1H3
InChIKey SOMMWEKQASCJDC-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C15H18N2
Exact Mass 226.146999 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BU3wHu2Jcn
Name 2-(1-pentyl-1H-indol-3-yl)acetonitrile
Appearance Yellowish oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18N2
InChI InChI=1S/C15H18N2/c1-2-3-6-11-17-12-13(9-10-16)14-7-4-5-8-15(14)17/h4-5,7-8,12H,2-3,6,9,11H2,1H3
InChIKey SOMMWEKQASCJDC-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010 Ultra
Ionization Type EI
Literature Reference DOI 10.1002/anie.201813631
Molecular Weight 226.323 g/mol
SMILES c1cc2c(cc1)[n](cc2CC#N)CCCCC
SPLASH splash10-004i-0290000000-ed276dfebcaca06a0de4
Source of Spectrum ACI-58-SM18-35
Wiley ID 1843086