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2',2'-Bis(methoxycarbonyl)bis(1,1':4',1"-terphenyl-4,4"-dimethyl)disulfide
SpectraBase Compound ID 57QFwiylTHN
InChI InChI=1S/C44H36O4S2/c1-47-43(45)41-37-5-3-6-38(41)34-19-11-30(12-20-34)26-50-28-32-15-23-36(24-16-32)40-8-4-7-39(42(40)44(46)48-2)35-21-13-31(14-22-35)27-49-25-29-9-17-33(37)18-10-29/h3-24H,25-28H2,1-2H3
InChIKey VKMSRWVQEAXUKM-UHFFFAOYSA-N
Mol Weight 692.9 g/mol
Molecular Formula C44H36O4S2
Exact Mass 692.205502 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzdIUSy9Aky
Name 2',2'-Bis(methoxycarbonyl)bis(1,1':4',1"-terphenyl-4,4"-dimethyl)disulfide
Alternate Name(s) 2',2'-Bis(methoxycarbonyl)bis(1,1':4',1''-terphenyl-4,4''-dimethyl)disulfide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H36O4S2
InChI InChI=1S/C44H36O4S2/c1-47-43(45)41-37-5-3-6-38(41)34-19-11-30(12-20-34)26-50-28-32-15-23-36(24-16-32)40-8-4-7-39(42(40)44(46)48-2)35-21-13-31(14-22-35)27-49-25-29-9-17-33(37)18-10-29/h3-24H,25-28H2,1-2H3
InChIKey VKMSRWVQEAXUKM-UHFFFAOYSA-N
Molecular Weight 692.888 g/mol
SMILES c1(c2-c3ccc(cc3)CSCc3ccc(-c4cccc(c4C(=O)OC)-c4ccc(CSCc5ccc(-c1ccc2)cc5)cc4)cc3)C(=O)OC
SPLASH splash10-0a4i-0098002000-97057147f40fa01f5b26
Source of Spectrum F-51-1330-10
Wiley ID 790697