| SpectraBase Spectrum ID |
8Imh9tPLnhA |
| Name |
Azepane TFA |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
195.087098498 u |
| Formula |
C8H12F3NO |
| InChI |
InChI=1S/C8H12F3NO/c9-8(10,11)7(13)12-5-3-1-2-4-6-12/h1-6H2 |
| InChIKey |
PASCSRGWXZOIMI-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
195.185 g/mol |
| Nominal Mass |
195 u |
| Quality |
990 |
| Retention Index |
1116 |
| SMILES |
C(N1CCCCCC1)(C(F)(F)F)=O |
| SPLASH |
splash10-05ox-9300000000-03ab81150dbaa28adb6b |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-Trifluoroacetyl-azepane
1-(azepan-1-yl)-2,2,2-trifluoroethan-1-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_013057 |
