SpectraBase Spectrum ID |
5XKu8YoDi7c |
Name |
Tranexamic acid PFP 2ME |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
331.120684256 u |
Formula |
C13H18F5NO3 |
InChI |
InChI=1S/C13H18F5NO3/c1-19(11(21)12(14,15)13(16,17)18)7-8-3-5-9(6-4-8)10(20)22-2/h8-9H,3-7H2,1-2H3/t8-,9- |
InChIKey |
VCDONXOVAWLZOP-KYZUINATSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
331.283 g/mol |
Nominal Mass |
331 u |
Quality |
993 |
Retention Index |
2376 |
SMILES |
C(C(N(C[C@]1(CC[C@](C(OC)=O)(CC1)[H])[H])C)=O)(C(F)(F)F)(F)F |
SPLASH |
splash10-0006-9720000000-31465abf552b7a21e594 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
methyl 4-((methyl(2,2,3,3,3-pentafluoropropanoyl)amino)methyl)cyclohexane-1-carboxylate |
Technique |
GC/MS |
Wiley ID |
DD2024_004091 |