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

*Links on SpectraBase are not permalinks.
2-(3-Carboxypropanoyl)benzoic acid
SpectraBase Compound ID DJVH8h0JD6N
InChI InChI=1S/C11H10O5/c12-9(5-6-10(13)14)7-3-1-2-4-8(7)11(15)16/h1-4H,5-6H2,(H,13,14)(H,15,16)
InChIKey YIVWQNVQRXFZJB-UHFFFAOYSA-N
Mol Weight 222.2 g/mol
Molecular Formula C11H10O5
Exact Mass 222.052823 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 Dd5DWCjM9Ik
Name 2-(3-Carboxypropanoyl)benzoic acid
Alternate Name(s) 2-(4-oxidanyl-4-oxidanylidene-butanoyl)benzoic acid 2-Succinylbenzoate 4-(2'-Carboxyphenyl)-4-oxobutyrate 4-(2'-Carboxyphenyl)-4-oxobutyric acid 4-(2-Carboxyphenyl)-4-oxobutanoic acid Benzenebutanoic acid, 2-carboxy-.gamma.-oxo- Benzenebutanoic acid, 2-carboxy-gamma-oxo- Benzoic acid, o-(3-carboxypropionyl)- O-succinylbenzoic acid
CAS Registry Number 27415-09-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10O5
InChI InChI=1S/C11H10O5/c12-9(5-6-10(13)14)7-3-1-2-4-8(7)11(15)16/h1-4H,5-6H2,(H,13,14)(H,15,16)
InChIKey YIVWQNVQRXFZJB-UHFFFAOYSA-N
Molecular Weight 222.196 g/mol
SMILES OC(c1ccccc1C(CCC(=O)O)=O)=O
SPLASH splash10-0002-3900000000-f9e0e5f94a60c0856b62
Wiley ID 1488621