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

*Links on SpectraBase are not permalinks.
Benzoic acid, 4-(5-amino-1,3,4-thiadiazol-2-ylthiomethyl)-
SpectraBase Compound ID 8kyFcMT0bmV
InChI InChI=1S/C10H9N3O2S2/c11-9-12-13-10(17-9)16-5-6-1-3-7(4-2-6)8(14)15/h1-4H,5H2,(H2,11,12)(H,14,15)
InChIKey QJKNFSPAYVEYDX-UHFFFAOYSA-N
Mol Weight 267.32 g/mol
Molecular Formula C10H9N3O2S2
Exact Mass 267.013619 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JfIjXofLA2y
Name benzoic acid, 4-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 267.013618888 u
Formula C10H9N3O2S2
InChI InChI=1S/C10H9N3O2S2/c11-9-12-13-10(17-9)16-5-6-1-3-7(4-2-6)8(14)15/h1-4H,5H2,(H2,11,12)(H,14,15)
InChIKey QJKNFSPAYVEYDX-UHFFFAOYSA-N
Molecular Weight 267.321 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9061
Solvent DMSO-d6
Source Vendor ID: NMR/9302946; Lab Info:LP