SpectraBase Spectrum ID |
OprHWeUTY |
Name |
3,6-Dimethyl-1-(4-nitrophenyl)pyridazinium trifluoroacetate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H12F3N3O4 |
InChI |
InChI=1S/C12H12N3O2.C2HF3O2/c1-9-3-4-10(2)14(13-9)11-5-7-12(8-6-11)15(16)17;3-2(4,5)1(6)7/h3-8H,1-2H3;(H,6,7)/q+1;/p-1 |
InChIKey |
NULWOZGICQYRNP-UHFFFAOYSA-M |
Literature Reference DOI |
10.1002/anie.201406175 |
Molecular Weight |
343.262 g/mol |
SMILES |
C(C(F)(F)F)([O-])=O.c1(ccc(-[n+]2nc(C)ccc2C)cc1)[N+](=O)[O-] |
SPLASH |
splash10-005a-9530000000-2ec8a591e34b46daab27 |
Source of Spectrum |
ACI-53-SM19-27 |
Synonyms |
3,6-Dimethyl-1-(4-nitrophenyl)pyridazin-1-ium 2,2,2-trifluoroacetate |
Wiley ID |
1782761 |