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Benzoic acid, 2,4-dimethoxy-5-bis(phenylthio)methyl-, 8,8-dimethoxy-2-octyl ester
SpectraBase Compound ID 5pcAj3Miq5F
InChI InChI=1S/C32H40O6S2/c1-23(15-9-6-14-20-29(36-4)37-5)38-31(33)30-27(21-24(34-2)22-28(30)35-3)32(39-25-16-10-7-11-17-25)40-26-18-12-8-13-19-26/h7-8,10-13,16-19,21-23,29,32H,6,9,14-15,20H2,1-5H3
InChIKey PEVCLPHHPOKOLB-UHFFFAOYSA-N
Mol Weight 584.8 g/mol
Molecular Formula C32H40O6S2
Exact Mass 584.226631 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GEvzpgVytFu
Name BENZOIC ACID, 2,4-DIMETHOXY-5-BIS(PHENYLTHIO)METHYL-, (8,8-DIMETHOXY-2-OCTYL) ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C32H40O6S2
InChI InChI=1S/C32H40O6S2/c1-23(15-9-6-14-20-29(36-4)37-5)38-31(33)30-27(21-24(34-2)22-28(30)35-3)32(39-25-16-10-7-11-17-25)40-26-18-12-8-13-19-26/h7-8,10-13,16-19,21-23,29,32H,6,9,14-15,20H2,1-5H3
InChIKey PEVCLPHHPOKOLB-UHFFFAOYSA-N
Molecular Weight 584.2256
SMILES c1c(OC)cc(C(Sc2ccccc2)Sc2ccccc2)c(C(OC(CCCCCC(OC)OC)C)=O)c1OC
SPLASH splash10-0udl-5908100000-a49fe24c75083f344d60
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany