SpectraBase Spectrum ID |
GYafDvNalxA |
Name |
Atropine TFA |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
385.150092677 u |
Formula |
C19H22F3NO4 |
InChI |
InChI=1S/C19H22F3NO4/c1-23-13-7-8-14(23)10-15(9-13)27-17(24)16(12-5-3-2-4-6-12)11-26-18(25)19(20,21)22/h2-6,13-16H,7-11H2,1H3/t13-,14+,15+,16? |
InChIKey |
GKYJCGNZIDENFC-SPUOUPEWSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
385.383 g/mol |
Nominal Mass |
385 u |
Quality |
700 |
Retention Index |
2918 |
SMILES |
[C@]1(C[C@@]2(N([C@](C1)(CC2)[H])C)[H])(OC(C(C=1C=CC=CC1)COC(C(F)(F)F)=O)=O)[H] |
SPLASH |
splash10-00ei-9713000000-c57fb6cb87c66a24c30f |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
8-methyl-8-azabicyclo[3.2.1]oct-3-yl-2-phenyl-3-((trifluoroacetyl)oxy)propanoate |
Technique |
GC/MS |
Wiley ID |
DD2024_000187 |