| SpectraBase Spectrum ID |
8IQsd7a2g5I |
| Name |
3'-Hydroxycotinine TFA |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
288.072176708 u |
| Formula |
C12H11F3N2O3 |
| InChI |
InChI=1S/C12H11F3N2O3/c1-17-8(7-3-2-4-16-6-7)5-9(10(17)18)20-11(19)12(13,14)15/h2-4,6,8-9H,5H2,1H3 |
| InChIKey |
LTUBDCCUNMTVAA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
288.226 g/mol |
| Nominal Mass |
288 u |
| Quality |
993 |
| Retention Index |
2205 |
| SMILES |
C1(N(C(C(C1)OC(C(F)(F)F)=O)=O)C)C1=CC=CN=C1 |
| SPLASH |
splash10-01b9-5900000000-9772149c6c320e875e4a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-methyl-2-oxo-5-(pyridin-3-yl)pyrrolidin-3-yl trifluoroacetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_034736 |
