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6-Methyl-4-oxo-2-phenyl-3,4-dihydro-2H-chromene-3-carbonitrile
SpectraBase Compound ID BWEmRJCNrXn
InChI InChI=1S/C17H13NO2/c1-11-7-8-15-13(9-11)16(19)14(10-18)17(20-15)12-5-3-2-4-6-12/h2-9,14,17H,1H3
InChIKey BJRDKAQULVGPGK-UHFFFAOYSA-N
Mol Weight 263.3 g/mol
Molecular Formula C17H13NO2
Exact Mass 263.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2LRwZEiHuR0
Name 6-Methyl-4-oxo-2-phenyl-3,4-dihydro-2H-chromene-3-carbonitrile
Alternate Name(s) 6-Methyl-4-oxo-2-phenylchroman-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13NO2
InChI InChI=1S/C17H13NO2/c1-11-7-8-15-13(9-11)16(19)14(10-18)17(20-15)12-5-3-2-4-6-12/h2-9,14,17H,1H3
InChIKey BJRDKAQULVGPGK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200700581
Molecular Weight 263.296 g/mol
SMILES C1(C(C(c2cc(ccc2O1)C)=O)C#N)c1ccccc1
SPLASH splash10-01q9-2940000000-ed3df1098acaa521de8b
Source of Spectrum ASC-350-817/SM4-4a+4a'
Wiley ID 1766155