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2-Methyl-2-(4-methyl-1H-indol-3-yl)propanenitrile
SpectraBase Compound ID HjWietdlLul
InChI InChI=1S/C13H14N2/c1-9-5-4-6-11-12(9)10(7-15-11)13(2,3)8-14/h4-7,15H,1-3H3
InChIKey XDVDBLXRRUFRQK-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 1zX46OVvJiL
Name 2-Methyl-2-(4-methyl-1H-indol-3-yl)propanenitrile
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2
InChI InChI=1S/C13H14N2/c1-9-5-4-6-11-12(9)10(7-15-11)13(2,3)8-14/h4-7,15H,1-3H3
InChIKey XDVDBLXRRUFRQK-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 [nH]1c2c(c(c1)C(C)(C#N)C)c(ccc2)C
SPLASH splash10-003r-0900000000-277560ac849cd108f5bf
Source of Spectrum JOC-86-8396-3qa
Wiley ID 1867828