SpectraBase Spectrum ID |
JGsYL3owJ6G |
Name |
Ketamine TFA |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
333.074340914 u |
Formula |
C15H15ClF3NO2 |
InChI |
InChI=1S/C15H15ClF3NO2/c1-20(13(22)15(17,18)19)14(9-5-4-8-12(14)21)10-6-2-3-7-11(10)16/h2-3,6-7H,4-5,8-9H2,1H3 |
InChIKey |
YIXRRRKGRKFADU-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
333.738 g/mol |
Nominal Mass |
333 u |
Quality |
928 |
Retention Index |
2423 |
SMILES |
C1(N(C(C(F)(F)F)=O)C)(C=2C(=CC=CC2)Cl)C(CCCC1)=O |
SPLASH |
splash10-03y0-2940000000-5abeb6a449a7e0e44567 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-(1-(2-chlorophenyl)-2-oxocyclohexyl)(trifluoro)-N-methylacetamide |
Technique |
GC/MS |
Wiley ID |
DD2024_011496 |