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Ephedrine 2PFP
SpectraBase Compound ID JP8fnWTFCdB
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
Mol Weight 457.27 g/mol
Molecular Formula C16H13F10NO3
Exact Mass 457.073575 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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