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3-(2-Carboxyethyl)-4-methoxybenzoic acid

View entire compound with spectra: 4 MS (GC)

3-(2-Carboxyethyl)-4-methoxybenzoic acid
SpectraBase Compound ID 4707Lx8ojzP
InChI InChI=1S/C11H12O5/c1-16-9-4-2-8(11(14)15)6-7(9)3-5-10(12)13/h2,4,6H,3,5H2,1H3,(H,12,13)(H,14,15)
InChIKey RECJMIVHSMHRMP-UHFFFAOYSA-N
Mol Weight 224.21 g/mol
Molecular Formula C11H12O5
Exact Mass 224.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GrYcVCqySMR
Name 3-(2-Carboxyethyl)-4-methoxybenzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O5
InChI InChI=1S/C11H12O5/c1-16-9-4-2-8(11(14)15)6-7(9)3-5-10(12)13/h2,4,6H,3,5H2,1H3,(H,12,13)(H,14,15)
InChIKey RECJMIVHSMHRMP-UHFFFAOYSA-N
Molecular Weight 224.212 g/mol
SMILES OC(CCc1c(ccc(C(=O)O)c1)OC)=O
SPLASH splash10-01dr-4920000000-c7de4373960cb0edcf3b
Synonyms 3-(3-hydroxy-3-oxopropyl)-4-methoxy-benzoic acid
Wiley ID 1476998