For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Coumarine-3-carbonitrile, 4-(2-hydroxyethenyl)-
SpectraBase Compound ID GyWWLEH5lXz
InChI InChI=1S/C12H7NO3/c13-7-10-8(5-6-14)9-3-1-2-4-11(9)16-12(10)15/h1-6,14H/b6-5+
InChIKey FLXQMTNRRQIWAJ-AATRIKPKSA-N
Mol Weight 213.19 g/mol
Molecular Formula C12H7NO3
Exact Mass 213.042593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DS3dj3owOSs
Name Coumarine-3-carbonitrile, 4-(2-hydroxyethenyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7NO3
InChI InChI=1S/C12H7NO3/c13-7-10-8(5-6-14)9-3-1-2-4-11(9)16-12(10)15/h1-6,14H/b6-5+
InChIKey FLXQMTNRRQIWAJ-AATRIKPKSA-N
Molecular Weight 213.192 g/mol
SMILES O\C=C\C1=C(C(Oc2c1cccc2)=O)C#N
SPLASH splash10-03di-7890000000-0663a4c9fbd18ef5792c
Source of Spectrum AD-0-2532-0
Synonyms 4-[(E)-2-hydroxyethenyl]-2-oxo-1-benzopyran-3-carbonitrile 4-[(E)-2-Hydroxyethenyl]-2-oxo-2H-chromene-3-carbonitrile 4-[(E)-2-hydroxyethenyl]-2-oxochromene-3-carbonitrile 4-[(E)-2-hydroxyvinyl]-2-keto-chromene-3-carbonitrile 4-[(E)-2-hydroxyvinyl]-2-oxo-chromene-3-carbonitrile 4-[(E)-2-oxidanylethenyl]-2-oxidanylidene-chromene-3-carbonitrile
Wiley ID 1431143