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5-tert-Butyl-5'-(tert-butylthio)-3,3'-diphenyl-2,2'-(1,4-phenylen)bis(thiophen)
SpectraBase Compound ID LfVGHm8RXnV
InChI InChI=1S/C34H34S3/c1-33(2,3)29-21-27(23-13-9-7-10-14-23)31(35-29)25-17-19-26(20-18-25)32-28(24-15-11-8-12-16-24)22-30(36-32)37-34(4,5)6/h7-22H,1-6H3
InChIKey QHOUBWLUFCQRCR-UHFFFAOYSA-N
Mol Weight 538.8 g/mol
Molecular Formula C34H34S3
Exact Mass 538.182265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NFzXSlhxAk
Name 5-tert-Butyl-5'-(tert-butylthio)-3,3'-diphenyl-2,2'-(1,4-phenylen)bis(thiophen)
Alternate Name(s) 5-(tert-butyl)-2-(4-(5-(tert-butylthio)-3-phenylthiophen-2-yl)phenyl)-3-phenylthiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H34S3
InChI InChI=1S/C34H34S3/c1-33(2,3)29-21-27(23-13-9-7-10-14-23)31(35-29)25-17-19-26(20-18-25)32-28(24-15-11-8-12-16-24)22-30(36-32)37-34(4,5)6/h7-22H,1-6H3
InChIKey QHOUBWLUFCQRCR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19881210218
Molecular Weight 538.826 g/mol
SMILES c1(sc(c(c1)-c1ccccc1)-c1ccc(cc1)-c1sc(cc1-c1ccccc1)C(C)(C)C)SC(C)(C)C
SPLASH splash10-05o0-4010920000-54bb3fb78207c4aaba14
Source of Spectrum K-121-322-24
Wiley ID 1799285