SpectraBase Spectrum ID |
EZi5IWDLoM0 |
Name |
1H-Pyrrole-2,3,4-tricarboxylic acid, 5-[4-(trifluoromethyl)phenyl]-, trimethyl ester |
CAS Registry Number |
89330-90-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H14F3NO6 |
InChI |
InChI=1S/C17H14F3NO6/c1-25-14(22)10-11(15(23)26-2)13(16(24)27-3)21-12(10)8-4-6-9(7-5-8)17(18,19)20/h4-7,21H,1-3H3 |
InChIKey |
DGACGFOZHBOSLD-UHFFFAOYSA-N |
Molecular Weight |
385.295 g/mol |
SMILES |
[nH]1c(c(c(c1C(=O)OC)C(=O)OC)C(=O)OC)-c1ccc(C(F)(F)F)cc1 |
SPLASH |
splash10-0fe0-0019000000-50c229dcf2ef0779c85b |
Source of Spectrum |
F-46-6479-9 |
Synonyms |
Trimethyl 5-(4'-trifluoromethylphenyl)pyrrole-2,3,4-tricarboxylate
Trimethyl 5-[4-(trifluoromethyl)phenyl]-1H-pyrrole-2,3,4-tricarboxylate |
Wiley ID |
1362099 |