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

*Links on SpectraBase are not permalinks.
4H-1,2,4-triazol-4-amine, 3-(difluoromethyl)-5-[[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]thio]-
SpectraBase Compound ID 9FqtfeLOJ9M
InChI InChI=1S/C9H11F2N7O2S/c1-4-6(18(19)20)5(2)16(15-4)3-21-9-14-13-8(7(10)11)17(9)12/h7H,3,12H2,1-2H3
InChIKey UDSNNHAUPITKHR-UHFFFAOYSA-N
Mol Weight 319.29 g/mol
Molecular Formula C9H11F2N7O2S
Exact Mass 319.0663 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 HvJhsVzUuKo
Name 4H-1,2,4-triazol-4-amine, 3-(difluoromethyl)-5-[[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]thio]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C9H11F2N7O2S/c1-4-6(18(19)20)5(2)16(15-4)3-21-9-14-13-8(7(10)11)17(9)12/h7H,3,12H2,1-2H3
InChIKey UDSNNHAUPITKHR-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_6753
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: R00388; Labnumber: RIBS-10388