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Bis[4-benzyl-5-(4-pyridyl)-1,2,4-triazole-5-yl]disulphide

View entire compound with spectra: 1 MS (GC)

Bis[4-benzyl-5-(4-pyridyl)-1,2,4-triazole-5-yl]disulphide
SpectraBase Compound ID 3GyQ3lp95dD
InChI InChI=1S/C28H22N8S2/c1-3-7-21(8-4-1)19-35-25(23-11-15-29-16-12-23)31-33-27(35)37-38-28-34-32-26(24-13-17-30-18-14-24)36(28)20-22-9-5-2-6-10-22/h1-18H,19-20H2
InChIKey RTKLRKURTVHHTI-UHFFFAOYSA-N
Mol Weight 534.66 g/mol
Molecular Formula C28H22N8S2
Exact Mass 534.140885 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CvI1UP2GZiy
Name Bis[4-benzyl-5-(4-pyridyl)-1,2,4-triazole-5-yl]disulphide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H22N8S2
InChI InChI=1S/C28H22N8S2/c1-3-7-21(8-4-1)19-35-25(23-11-15-29-16-12-23)31-33-27(35)37-38-28-34-32-26(24-13-17-30-18-14-24)36(28)20-22-9-5-2-6-10-22/h1-18H,19-20H2
InChIKey RTKLRKURTVHHTI-UHFFFAOYSA-N
Molecular Weight 534.660 g/mol
SMILES c1([n](c(nn1)-c1ccncc1)Cc1ccccc1)SSc1[n](c(-c2ccncc2)nn1)Cc1ccccc1
SPLASH splash10-00kf-9180000000-5688a64bdfb0fd7e1b28
Source of Spectrum F7-24-271-2
Synonyms 4-(4-benzyl-5-{[4-benzyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]disulfanyl}-4H-1,2,4-triazol-3-yl)pyridine bis[4-benzyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]disulfide
Wiley ID 1556950