| SpectraBase Spectrum ID |
JILqNlSS54q |
| Name |
3-Phenylpropylamine HFB |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
331.080711150 u |
| Formula |
C13H12F7NO |
| InChI |
InChI=1S/C13H12F7NO/c14-11(15,12(16,17)13(18,19)20)10(22)21-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,21,22) |
| InChIKey |
WSLOVKUTYAQMOA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
331.234 g/mol |
| Nominal Mass |
331 u |
| Quality |
923 |
| Retention Index |
1577 |
| SMILES |
C(C(C(F)(F)F)(F)F)(C(NCCCC=1C=CC=CC1)=O)(F)F |
| SPLASH |
splash10-014l-9800000000-666c17d1bde430724b15 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2,2,3,3,4,4,4-Heptafluoro-N-(3-phenylpropyl)butanamide
trifluoro-N-(1-(4-(2-fluoroethoxy)-3,5-dimethoxyphenyl)propan-2-yl)acetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_021912 |
