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Bromantane HFB
SpectraBase Compound ID K5zyvSdvR3k
InChI InChI=1S/C20H19BrF7NO/c21-14-1-3-15(4-2-14)29(16(30)18(22,23)19(24,25)20(26,27)28)17-8-11-5-12(9-17)7-13(6-11)10-17/h1-4,11-13H,5-10H2/t11-,12+,13?,17-
InChIKey QYOYWSNGNDPYKK-PHRHEHMNSA-N
Mol Weight 502.27 g/mol
Molecular Formula C20H19BrF7NO
Exact Mass 501.053824 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4KlXjnOW8W
Name Bromantane HFB
Classification Stimulant Doping agent
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Exact Mass 501.053824376 u
Formula C20H19BrF7NO
InChI InChI=1S/C20H19BrF7NO/c21-14-1-3-15(4-2-14)29(16(30)18(22,23)19(24,25)20(26,27)28)17-8-11-5-12(9-17)7-13(6-11)10-17/h1-4,11-13H,5-10H2/t11-,12+,13?,17-
InChIKey QYOYWSNGNDPYKK-PHRHEHMNSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 502.271 g/mol
SMILES c1(ccc(Br)cc1)N([C@]12C[C@]3(C[C@@](C2)(CC(C1)C3)[H])[H])C(C(C(C(F)(F)F)(F)F)(F)F)=O
SPLASH splash10-00n3-9600000000-0e8a5fe36db13e8d7095
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_6145