| SpectraBase Spectrum ID |
JI7IXeB5sI4 |
| Name |
Ephedrine 2TFA |
| CAS Registry Number |
50-98-6 |
| Classification |
Pharmaceutical drug derivative |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
357.079962258 u |
| Formula |
C14H13F6NO3 |
| InChI |
InChI=1S/C14H13F6NO3/c1-8(21(2)11(22)13(15,16)17)10(9-6-4-3-5-7-9)24-12(23)14(18,19)20/h3-8,10H,1-2H3/t8-,10+/m1/s1 |
| InChIKey |
KMUFRRQXCALIPC-SCZZXKLOSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
357.252 g/mol |
| Nominal Mass |
357 u |
| Quality |
933 |
| Retention Index |
2565 |
| SMILES |
[C@@]([C@](N(C(C(F)(F)F)=O)C)(C)[H])(C1=CC=CC=C1)(OC(C(F)(F)F)=O)[H] |
| SPLASH |
splash10-0udi-2900000000-d71cfdd0813c7f2bcfbf |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(1R,2R)-2-(methyl(trifluoroacetyl)amino)-1-phenylpropyl trifluoroacetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_017447 |
