SpectraBase Spectrum ID |
LWran8qf1LK |
Name |
Methyl 1-[3-(Trifluoromethyl)phenyl]-1H-1,2,4-triazole-3-carboxylate |
Appearance |
Yellow solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C11H8F3N3O2 |
InChI |
InChI=1S/C11H8F3N3O2/c1-19-10(18)9-15-6-17(16-9)8-4-2-3-7(5-8)11(12,13)14/h2-6H,1H3 |
InChIKey |
NUEXHMFKBJHJGG-UHFFFAOYSA-N |
Instrument Name |
JEOL JMS-HX110 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/ejoc.201801808 |
Molecular Weight |
271.199 g/mol |
Reported Formula |
C11H8F3N3O2 |
SMILES |
COC(=O)c1n[n](cn1)-c1cccc(c1)C(F)(F)F |
SPLASH |
splash10-06xx-0390000000-1adcf4e94c2073ff9480 |
Source of Spectrum |
U1-2019-1759-2c |
Wiley ID |
1846107 |