For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-(3-benzyl-4-phenyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one

Compound with spectra: 1 NMR, and 1 MS (GC)

2-(3-benzyl-4-phenyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
SpectraBase Compound ID 1kTGbDDgxno
InChI InChI=1S/C20H18N4O3S/c25-16-11-15(17-12-26-18(16)27-17)24-20(28)23(14-9-5-2-6-10-14)19(22-24)21-13-7-3-1-4-8-13/h1-10,15,17-18H,11-12H2,(H,21,22)/t15-,17+,18+/m0/s1
InChIKey VETSUJWTOQSCMW-CGTJXYLNSA-N
Mol Weight 394.45 g/mol
Molecular Formula C20H18N4O3S
Exact Mass 394.109962 g/mol
Enantiomer InChIKey VETSUJWTOQSCMW-NJAFHUGGSA-N

View Spectrum of 2-(3-benzyl-4-phenyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one

1H NMR Spectrum
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent DMSO-d6

View Spectrum of 2-(3-benzyl-4-phenyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
  • 2-(3-anilino-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
(1R,2R,5S)-2-(3-(phenoxymethyl)-4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
(1S,2S,5R)-2-(4-benzyl-3-(4-chlorophenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
(1R,5S)-2-(3-(2-chlorophenyl)-4-methyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
(1S,2S,5R)-2-(3-(furan-2-yl)-4-methyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
2-[4-(1,3-benzodioxol-5-yl)-5-sulfanylidene-1,2,3,4-tetrazol-1-yl]-6,8-dioxabicyclo[3.2.1]octan-4-one
5-[4-(4-keto-6,8-dioxabicyclo[3.2.1]octan-2-yl)-5-thioxo-tetrazol-1-yl]phthalide
(1S,5R)-2-(4-(naphthalen-1-yl)-5-thioxo-4,5-dihydro-1H-tetrazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
2-[4-(2-methoxyphenyl)-5-sulfanylidene-1,2,3,4-tetrazol-1-yl]-6,8-dioxabicyclo[3.2.1]octan-4-one
(1S,2S,5R)-2-(3-((1R,2R,5S)-4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-2-thioxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
4-Allyl-5-(2-chlorophenyl)-2-(7,8-dioxabicyclo[3.2.1]octan-4-yl)-1,2,4-triazole-3-thione
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.