| SpectraBase Spectrum ID |
2nD49UNlGDY |
| Name |
Nifedipine TFA |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
442.098785377 u |
| Formula |
C19H17F3N2O7 |
| InChI |
InChI=1S/C19H17F3N2O7/c1-9-13(16(25)30-3)15(11-7-5-6-8-12(11)24(28)29)14(17(26)31-4)10(2)23(9)18(27)19(20,21)22/h5-8,15H,1-4H3 |
| InChIKey |
RAMCHSPZQIWHRC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
442.347 g/mol |
| Nominal Mass |
442 u |
| Quality |
954 |
| Retention Index |
2350 |
| SMILES |
C1(C(=C(N(C(=C1C(OC)=O)C)C(C(F)(F)F)=O)C)C(OC)=O)C1=C([N+](=O)[O-])C=CC=C1 |
| SPLASH |
splash10-00li-3987000000-f939ea4636f7d246816c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
dimethyl 2,6-dimethyl-4-(2-nitrophenyl)-1-(trifluoroacetyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_013017 |
