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2'-(Cyano)bis(1,1':4',1"-terphenyl-4,4"-dimethyl)disulfide

View entire compound with spectra: 1 MS (GC)

2'-(Cyano)bis(1,1':4',1"-terphenyl-4,4"-dimethyl)disulfide
SpectraBase Compound ID Bsr5PAY8AF9
InChI InChI=1S/C41H31NS2/c42-24-41-39-5-2-6-40(41)36-21-13-32(14-22-36)28-44-26-30-9-17-34(18-10-30)38-4-1-3-37(23-38)33-15-7-29(8-16-33)25-43-27-31-11-19-35(39)20-12-31/h1-23H,25-28H2
InChIKey UJFUYXQLRITWRF-UHFFFAOYSA-N
Mol Weight 601.8 g/mol
Molecular Formula C41H31NS2
Exact Mass 601.189792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KsdjIE62L9C
Name 2'-(Cyano)bis(1,1':4',1"-terphenyl-4,4"-dimethyl)disulfide
Alternate Name(s) 2'-(Cyano)bis(1,1':4',1''-terphenyl-4,4''-dimethyl)disulfide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C41H31NS2
InChI InChI=1S/C41H31NS2/c42-24-41-39-5-2-6-40(41)36-21-13-32(14-22-36)28-44-26-30-9-17-34(18-10-30)38-4-1-3-37(23-38)33-15-7-29(8-16-33)25-43-27-31-11-19-35(39)20-12-31/h1-23H,25-28H2
InChIKey UJFUYXQLRITWRF-UHFFFAOYSA-N
Molecular Weight 601.826 g/mol
SMILES c1(c2-c3ccc(cc3)CSCc3ccc(-c4cccc(c4)-c4ccc(CSCc5ccc(-c1ccc2)cc5)cc4)cc3)C#N
SPLASH splash10-0pbi-0090013000-bed42fcda958b3791a1e
Source of Spectrum F-51-1330-10
Wiley ID 790700