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1-Ethyl-2-methyl-1H-indole-3-carbonitrile
SpectraBase Compound ID 4iOQUogYdmL
InChI InChI=1S/C12H12N2/c1-3-14-9(2)11(8-13)10-6-4-5-7-12(10)14/h4-7H,3H2,1-2H3
InChIKey GISWIGCXCMKUMW-UHFFFAOYSA-N
Mol Weight 184.24 g/mol
Molecular Formula C12H12N2
Exact Mass 184.100048 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ALILInnY8
Name 1-Ethyl-2-methyl-1H-indole-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2
InChI InChI=1S/C12H12N2/c1-3-14-9(2)11(8-13)10-6-4-5-7-12(10)14/h4-7H,3H2,1-2H3
InChIKey GISWIGCXCMKUMW-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol1000439
Molecular Weight 184.242 g/mol
SMILES c1ccc2[n](c(c(c2c1)C#N)C)CC
SPLASH splash10-0159-0900000000-316230ff3182f354344b
Source of Spectrum A1-12-1052/SMS11-5n
Synonyms 1-Ethyl-2-methyl-3-indolecarbonitrile 1-Ethyl-2-methylindole-3-carbonitrile
Wiley ID 1751929