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4-oxo-4H-1-benzopyran-3-acetonitrile
SpectraBase Compound ID KJqSLYPWhwa
InChI InChI=1S/C11H7NO2/c12-6-5-8-7-14-10-4-2-1-3-9(10)11(8)13/h1-4,7H,5H2
InChIKey MWFRVPWQZBMOJD-UHFFFAOYSA-N
Mol Weight 185.18 g/mol
Molecular Formula C11H7NO2
Exact Mass 185.047678 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID E9q3vZEDouz
Name 4-OXO-4H-1-BENZOPYRAN-3-ACETONITRILE
Source of Sample S. Klutchko, Warner-Lambert Research Institute, Morris Plains, New Jersey
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7NO2
InChI InChI=1S/C11H7NO2/c12-6-5-8-7-14-10-4-2-1-3-9(10)11(8)13/h1-4,7H,5H2
InChIKey MWFRVPWQZBMOJD-UHFFFAOYSA-N
Literature Reference J. HETEROCYCLIC CHEM. 11, 183(1974)
Melting Point 137-139C
Molecular Weight 185.182007
Synonyms BENZOPYRAN-3-ACETONITRILE, 4H-1-, 4-OXO-,
Technique KBr WAFER