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Benzoic acid, 2-hydroxy-4-methoxy-6-methyl-, 3-(methoxycarbonyl)phenyl ester

View entire compound with spectra: 1 MS (GC)

Benzoic acid, 2-hydroxy-4-methoxy-6-methyl-, 3-(methoxycarbonyl)phenyl ester
SpectraBase Compound ID 89Q2o25W6p2
InChI InChI=1S/C17H16O6/c1-10-7-13(21-2)9-14(18)15(10)17(20)23-12-6-4-5-11(8-12)16(19)22-3/h4-9,18H,1-3H3
InChIKey PNDIGXNNXCJVPY-UHFFFAOYSA-N
Mol Weight 316.31 g/mol
Molecular Formula C17H16O6
Exact Mass 316.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GRx7zo9t46i
Name Benzoic acid, 2-hydroxy-4-methoxy-6-methyl-, 3-(methoxycarbonyl)phenyl ester
CAS Registry Number 113500-96-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O6
InChI InChI=1S/C17H16O6/c1-10-7-13(21-2)9-14(18)15(10)17(20)23-12-6-4-5-11(8-12)16(19)22-3/h4-9,18H,1-3H3
InChIKey PNDIGXNNXCJVPY-UHFFFAOYSA-N
Molecular Weight 316.309 g/mol
SMILES Oc1c(C(Oc2cc(C(=O)OC)ccc2)=O)c(cc(OC)c1)C
SPLASH splash10-00di-0900000000-33dbb5ec961592eab743
Source of Spectrum B-40-1458-11
Synonyms 3'-Methoxycarbonylphenyl 2-hydroxy-4-methoxy-6-methylbenzoate 3-(methoxycarbonyl)phenyl 2-hydroxy-4-methoxy-6-methylbenzoate
Wiley ID 1316666