| SpectraBase Spectrum ID |
BkjhpQW9AzX |
| Name |
p-Fluoro-benzoyltropine |
| CAS Registry Number |
96920-56-8 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
247.137242366 u |
| Formula |
C15H18FNO |
| InChI |
InChI=1S/C15H18FNO/c1-17-13-6-7-14(17)9-11(8-13)15(18)10-2-4-12(16)5-3-10/h2-5,11,13-14H,6-9H2,1H3/t11?,13-,14+ |
| InChIKey |
SFKXMCNVYWUQCL-QXMXGUDHSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
247.313 g/mol |
| Nominal Mass |
247 u |
| Quality |
1000 |
| Retention Index |
1930 |
| SMILES |
C1(C(C=2C=CC(=CC2)F)=O)C[C@]2(N([C@@](C1)(CC2)[H])C)[H] |
| SPLASH |
splash10-008c-9200000000-7fa146edd37479b7d49b |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-(4-Fluorobenzoyl)tropane
(4-Fluorophenyl)-(8-methyl-azabicyclo-[3,2,1]-octan-yl)methanone |
| Technique |
GC/MS |
| Wiley ID |
DD2024_014539 |
