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Benzoic acid, 2-hydroxy-4-[[2-methoxy-6-methyl-3,4-bis(phenylmethoxy)benzoyl]oxy]-6-methyl-, 3-hydroxy-5-methyl-4-[(phenylmethoxy)carbonyl]phenyl ester
SpectraBase Compound ID FfMimGwgjtQ
InChI InChI=1S/C46H40O11/c1-28-20-34(23-36(47)39(28)44(49)55-27-33-18-12-7-13-19-33)56-45(50)40-29(2)21-35(24-37(40)48)57-46(51)41-30(3)22-38(53-25-31-14-8-5-9-15-31)42(43(41)52-4)54-26-32-16-10-6-11-17-32/h5-24,47-48H,25-27H2,1-4H3
InChIKey CNMVGXLLYQFTCK-UHFFFAOYSA-N
Mol Weight 768.8 g/mol
Molecular Formula C46H40O11
Exact Mass 768.257062 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GjYL78UKfnk
Name Benzoic acid, 2-hydroxy-4-[[2-methoxy-6-methyl-3,4-bis(phenylmethoxy)benzoyl]oxy]-6-methyl-, 3-hydroxy-5-methyl-4-[(phenylmethoxy)carbonyl]phenyl ester
CAS Registry Number 124281-20-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C46H40O11
InChI InChI=1S/C46H40O11/c1-28-20-34(23-36(47)39(28)44(49)55-27-33-18-12-7-13-19-33)56-45(50)40-29(2)21-35(24-37(40)48)57-46(51)41-30(3)22-38(53-25-31-14-8-5-9-15-31)42(43(41)52-4)54-26-32-16-10-6-11-17-32/h5-24,47-48H,25-27H2,1-4H3
InChIKey CNMVGXLLYQFTCK-UHFFFAOYSA-N
Molecular Weight 768.815 g/mol
SMILES Oc1cc(cc(c1C(Oc1cc(c(c(c1)C)C(OCc1ccccc1)=O)O)=O)C)OC(c1c(c(OCc2ccccc2)c(cc1C)OCc1ccccc1)OC)=O
SPLASH splash10-0006-9000000000-2d74c076f6c1eb3b9b1c
Source of Spectrum B-42-769-17
Synonyms 4-({4-[(benzyloxy)carbonyl]-3-hydroxy-5-methylphenoxy}carbonyl)-3-hydroxy-5-methylphenyl 3,4-bis(benzyloxy)-2-methoxy-6-methylbenzoate Benzyl 3-benzyloxy-4-O-benzylumbilicarate
Wiley ID 1416687