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

*Links on SpectraBase are not permalinks.
Benzoic acid, 2-hydroxy-4-[(6-hydroxy-3,4-dimethoxy-2-methylbenzoyl)oxy]-6-methyl-, 3-hydroxy-5-methyl-4-[(phenylmethoxy)carbonyl]phenyl ester
SpectraBase Compound ID JLsVLU1w1Lz
InChI InChI=1S/C33H30O11/c1-17-11-21(13-23(34)27(17)31(37)42-16-20-9-7-6-8-10-20)43-32(38)28-18(2)12-22(14-24(28)35)44-33(39)29-19(3)30(41-5)26(40-4)15-25(29)36/h6-15,34-36H,16H2,1-5H3
InChIKey IUTWPSMPRDUJRX-UHFFFAOYSA-N
Mol Weight 602.6 g/mol
Molecular Formula C33H30O11
Exact Mass 602.178812 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 35rlhre3SrZ
Name Benzoic acid, 2-hydroxy-4-[(6-hydroxy-3,4-dimethoxy-2-methylbenzoyl)oxy]-6-methyl-, 3-hydroxy-5-methyl-4-[(phenylmethoxy)carbonyl]phenyl ester
CAS Registry Number 61823-87-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H30O11
InChI InChI=1S/C33H30O11/c1-17-11-21(13-23(34)27(17)31(37)42-16-20-9-7-6-8-10-20)43-32(38)28-18(2)12-22(14-24(28)35)44-33(39)29-19(3)30(41-5)26(40-4)15-25(29)36/h6-15,34-36H,16H2,1-5H3
InChIKey IUTWPSMPRDUJRX-UHFFFAOYSA-N
Molecular Weight 602.592 g/mol
SMILES Oc1cc(cc(c1C(Oc1cc(c(c(c1)C)C(OCc1ccccc1)=O)O)=O)C)OC(c1c(c(OC)c(cc1O)OC)C)=O
SPLASH splash10-0006-9120000000-b8bfc4f573d08c7e0d2a
Source of Spectrum B-29-2704-0
Synonyms 4-({4-[(benzyloxy)carbonyl]-3-hydroxy-5-methylphenoxy}carbonyl)-3-hydroxy-5-methylphenyl 6-hydroxy-3,4-dimethoxy-2-methylbenzoate Benzyl 4,5-di-O-methylhiascate
Wiley ID 1410297