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2-(5-Methoxy-1H-indol-3-yl)-2-methylpropanenitrile
SpectraBase Compound ID BenI2j299cT
InChI InChI=1S/C13H14N2O/c1-13(2,8-14)11-7-15-12-5-4-9(16-3)6-10(11)12/h4-7,15H,1-3H3
InChIKey ZHDVNWHEEPLIBL-UHFFFAOYSA-N
Mol Weight 214.27 g/mol
Molecular Formula C13H14N2O
Exact Mass 214.110613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A9t9wufgpIl
Name 2-(5-Methoxy-1H-indol-3-yl)-2-methylpropanenitrile
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O
InChI InChI=1S/C13H14N2O/c1-13(2,8-14)11-7-15-12-5-4-9(16-3)6-10(11)12/h4-7,15H,1-3H3
InChIKey ZHDVNWHEEPLIBL-UHFFFAOYSA-N
Instrument Name SHIMADZU GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00808
Molecular Weight 214.268 g/mol
Reported Formula C13H14N2O
SMILES [nH]1cc(c2c1ccc(c2)OC)C(C#N)(C)C
SPLASH splash10-01ot-0930000000-76a28e13b4b997850673
Source of Spectrum JOC-86-8394-3ba
Wiley ID 1867813