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1-(1H-Indol-3-yl)cyclohexane-1-carbonitrile
SpectraBase Compound ID J0bjdn32lgH
InChI InChI=1S/C15H16N2/c16-11-15(8-4-1-5-9-15)13-10-17-14-7-3-2-6-12(13)14/h2-3,6-7,10,17H,1,4-5,8-9H2
InChIKey XRLLPCHGZPDUJW-UHFFFAOYSA-N
Mol Weight 224.31 g/mol
Molecular Formula C15H16N2
Exact Mass 224.131349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JqRyr8C24
Name 1-(1H-Indol-3-yl)cyclohexane-1-carbonitrile
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16N2
InChI InChI=1S/C15H16N2/c16-11-15(8-4-1-5-9-15)13-10-17-14-7-3-2-6-12(13)14/h2-3,6-7,10,17H,1,4-5,8-9H2
InChIKey XRLLPCHGZPDUJW-UHFFFAOYSA-N
Instrument Name SHIMADZU GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00808
Molecular Weight 224.307 g/mol
Reported Formula C15H16N2
SMILES [nH]1cc(c2c1cccc2)C1(CCCCC1)C#N
SPLASH splash10-01c0-0910000000-ce552579d9248e448093
Source of Spectrum JOC-86-8396-3ab
Wiley ID 1867810