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

*Links on SpectraBase are not permalinks.
5-Methoxymethyl-1-(2-nitro-4-trifluoromethyl-phenyl)-1H-[1,2,3]triazole-4-carboxylic acid methyl ester
SpectraBase Compound ID KTHBGk223FS
InChI InChI=1S/C13H11F3N4O5/c1-24-6-10-11(12(21)25-2)17-18-19(10)8-4-3-7(13(14,15)16)5-9(8)20(22)23/h3-5H,6H2,1-2H3
InChIKey VTOIAHFMPUTWPD-UHFFFAOYSA-N
Mol Weight 360.25 g/mol
Molecular Formula C13H11F3N4O5
Exact Mass 360.068154 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 7bJiR5bbz8U
Name 1H-1,2,3-triazole-4-carboxylic acid, 5-(methoxymethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.068153954 u
Formula C13H11F3N4O5
InChI InChI=1S/C13H11F3N4O5/c1-24-6-10-11(12(21)25-2)17-18-19(10)8-4-3-7(13(14,15)16)5-9(8)20(22)23/h3-5H,6H2,1-2H3
InChIKey VTOIAHFMPUTWPD-UHFFFAOYSA-N
Molecular Weight 360.249 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6111
Solvent DMSO-d6
Source Vendor ID: NMR/10320578; Lab Info: VUR; Lab Number: VUR-01012576