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

*Links on SpectraBase are not permalinks.
2-(2-ketochromen-3-yl)benzoic acid methyl ester
SpectraBase Compound ID CR6gUAuSEox
InChI InChI=1S/C17H12O4/c1-20-16(18)13-8-4-3-7-12(13)14-10-11-6-2-5-9-15(11)21-17(14)19/h2-10H,1H3
InChIKey HRQMNZXTNMKJCD-UHFFFAOYSA-N
Mol Weight 280.28 g/mol
Molecular Formula C17H12O4
Exact Mass 280.073559 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 4FKAXAXVcI7
Name 2-(2-ketochromen-3-yl)benzoic acid methyl ester
Alternate Name(s) 2-(2-oxo-1-benzopyran-3-yl)benzoic acid methyl ester Methyl 2-(2-oxidanylidenechromen-3-yl)benzoate Methyl 2-(2-oxochromen-3-yl)benzoate
CAS Registry Number 69976-35-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12O4
InChI InChI=1S/C17H12O4/c1-20-16(18)13-8-4-3-7-12(13)14-10-11-6-2-5-9-15(11)21-17(14)19/h2-10H,1H3
InChIKey HRQMNZXTNMKJCD-UHFFFAOYSA-N
Molecular Weight 280.279 g/mol
SMILES C=1(C(Oc2c(C1)cccc2)=O)c1c(C(=O)OC)cccc1
SPLASH splash10-008a-0090000000-35cf688d42be13cff73f
Source of Spectrum Y-16-99-2
Wiley ID 1284060