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

*Links on SpectraBase are not permalinks.
Benzoic acid, 3-formyl-2,4-dihydroxy-6-methyl-, ethyl ester
SpectraBase Compound ID KLCvGlc9XqV
InChI InChI=1S/C11H12O5/c1-3-16-11(15)9-6(2)4-8(13)7(5-12)10(9)14/h4-5,13-14H,3H2,1-2H3
InChIKey HUXJGSHUVDWZAM-UHFFFAOYSA-N
Mol Weight 224.21 g/mol
Molecular Formula C11H12O5
Exact Mass 224.068473 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 Asg8oOna1Gy
Name Benzoic acid, 3-formyl-2,4-dihydroxy-6-methyl-, ethyl ester
CAS Registry Number 39503-14-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O5
InChI InChI=1S/C11H12O5/c1-3-16-11(15)9-6(2)4-8(13)7(5-12)10(9)14/h4-5,13-14H,3H2,1-2H3
InChIKey HUXJGSHUVDWZAM-UHFFFAOYSA-N
Molecular Weight 224.212 g/mol
SMILES Oc1cc(c(c(c1C=O)O)C(=O)OCC)C
SPLASH splash10-0uk9-0930000000-0228ecbd96abeb60df0e
Source of Spectrum E1-39-1043-4
Synonyms 3-formyl-2,4-dihydroxy-6-methyl-benzoic acid ethyl ester Ethyl 3-formyl-2,4-dihydroxy-6-methyl-benzoate Ethyl 3-methanoyl-6-methyl-2,4-bis(oxidanyl)benzoate Ethyl haematommate Ethyl Hematommate Haematommic acid ethyl ester Hematommic acid ethyl ester 3-formyl-2,4-dihydroxy-6-methylbenzoic acid ethyl ester
Wiley ID 1518798