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Benzoic acid, 5-[2-acetoxy-4,6-bis(ethoxycarbonylmethyl)cyclohexyl]-2,4-dimethoxyphenyl ester
SpectraBase Compound ID 3ATGlnVp8OG
InChI InChI=1S/C31H38O10/c1-6-38-28(33)15-20-13-22(16-29(34)39-7-2)30(27(14-20)40-19(3)32)23-17-26(25(37-5)18-24(23)36-4)41-31(35)21-11-9-8-10-12-21/h8-12,17-18,20,22,27,30H,6-7,13-16H2,1-5H3
InChIKey AQZVVIPCBBMDNB-UHFFFAOYSA-N
Mol Weight 570.6 g/mol
Molecular Formula C31H38O10
Exact Mass 570.246497 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KYbJP8HDc3w
Name BENZOIC ACID, 5-(2-ACETOXY-4,6-BIS-ETHOXYCARBONYLMETHYLCYCLOHEXYL)-2,4-DIMETHOXYPHENYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C31H38O10
InChI InChI=1S/C31H38O10/c1-6-38-28(33)15-20-13-22(16-29(34)39-7-2)30(27(14-20)40-19(3)32)23-17-26(25(37-5)18-24(23)36-4)41-31(35)21-11-9-8-10-12-21/h8-12,17-18,20,22,27,30H,6-7,13-16H2,1-5H3
InChIKey AQZVVIPCBBMDNB-UHFFFAOYSA-N
Molecular Weight 570.2454
SMILES c1c(C2C(CC(OCC)=O)CC(CC(OCC)=O)CC2OC(C)=O)c(OC)cc(OC)c1OC(c1ccccc1)=O
SPLASH splash10-0a4i-2923120000-48a8fa03c6e53475da43
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany