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

*Links on SpectraBase are not permalinks.
5-AMINO-3-METHYLTHIO-1-(2-NITROPHENYL)-1H-1,2,4-TRIAZOLE
SpectraBase Compound ID FZK1HNOCEJK
InChI InChI=1S/C9H9N5O2S/c1-17-9-11-8(10)13(12-9)6-4-2-3-5-7(6)14(15)16/h2-5H,1H3,(H2,10,11,12)
InChIKey QVRAIUFMRDAENA-UHFFFAOYSA-N
Mol Weight 251.26 g/mol
Molecular Formula C9H9N5O2S
Exact Mass 251.047696 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 8JFdDVL9oS9
Name 5-AMINO-3-METHYLTHIO-1-(2-NITROPHENYL)-1H-1,2,4-TRIAZOLE
Compound Number 8/1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9N5O2S
InChI InChI=1S/C9H9N5O2S/c1-17-9-11-8(10)13(12-9)6-4-2-3-5-7(6)14(15)16/h2-5H,1H3,(H2,10,11,12)
InChIKey QVRAIUFMRDAENA-UHFFFAOYSA-N
Literature Reference Author P.TRINKA,J.REITER
Literature Reference Citation J.HETCYCL.CHEM.,32,1359(1995)
Literature Reference DOI 10.1002/jhet.5570320443
Molecular Weight 251.263 g/mol
Solvent DMSO-D6
Source File Reference UWMZ3021