SpectraBase Spectrum ID |
JHhMJ4GFYNU |
Name |
Ephedrine 2PFP |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
457.073574910 u |
Formula |
C16H13F10NO3 |
InChI |
InChI=1S/C16H13F10NO3/c1-8(27(2)11(28)13(17,18)15(21,22)23)10(9-6-4-3-5-7-9)30-12(29)14(19,20)16(24,25)26/h3-8,10H,1-2H3/t8-,10+/m1/s1 |
InChIKey |
HAQQDHLYHSZNEW-SCZZXKLOSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
457.268 g/mol |
Nominal Mass |
457 u |
Quality |
943 |
Retention Index |
3236 |
SMILES |
C(C(N([C@@]([C@@](C1=CC=CC=C1)(OC(C(C(F)(F)F)(F)F)=O)[H])(C)[H])C)=O)(C(F)(F)F)(F)F |
SPLASH |
splash10-0udi-0290000000-ee7edae90cd167723be3 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(1R,2R)-2-(methyl(2,2,3,3,3-pentafluoropropanoyl)amino)-1-phenylpropyl 2,2,3,3,3-\rpentafluoropropanoate |
Technique |
GC/MS |
Wiley ID |
DD2024_001294 |