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2-(p-anisyl)-1-cyclohexenylacetonitrile
SpectraBase Compound ID FKqiCF8dhdR
InChI InChI=1S/C15H17NO/c1-17-14-8-6-13(7-9-14)15-5-3-2-4-12(15)10-11-16/h6-9H,2-5,10H2,1H3
InChIKey CZGXLWQFSRSHEW-UHFFFAOYSA-N
Mol Weight 227.31 g/mol
Molecular Formula C15H17NO
Exact Mass 227.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CJv0umrzqPk
Name 2-(p-anisyl)-1-cyclohexenylacetonitrile
Alternate Name(s) [2-(4-methoxyphenyl)-1-cyclohexen-1-yl]acetonitrile
CAS Registry Number 116998-11-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO
InChI InChI=1S/C15H17NO/c1-17-14-8-6-13(7-9-14)15-5-3-2-4-12(15)10-11-16/h6-9H,2-5,10H2,1H3
InChIKey CZGXLWQFSRSHEW-UHFFFAOYSA-N
Molecular Weight 227.307 g/mol
SMILES C1(=C(CC#N)CCCC1)c1ccc(cc1)OC
SPLASH splash10-054o-8910000000-f8c0cfa5c5a3bc6e9c57
Source of Spectrum J-53-6067-3
Wiley ID 1228860