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Benzylpiperazine-M (HO-meth.-) TFA    @
SpectraBase Compound ID I9ht3hUDViW
InChI InChI=1S/C14H17F3N2O3/c1-22-12-8-10(2-3-11(12)20)9-18-4-6-19(7-5-18)13(21)14(15,16)17/h2-3,8,20H,4-7,9H2,1H3
InChIKey DTOHFIKVIZTCRY-UHFFFAOYSA-N
Mol Weight 318.3 g/mol
Molecular Formula C14H17F3N2O3
Exact Mass 318.119127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57NdW2W7Xsz
Name Benzylpiperazine-M (HO-meth.-) TFA @
Classification Designer drug
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 318.119126901 u
Formula C14H17F3N2O3
InChI InChI=1S/C14H17F3N2O3/c1-22-12-8-10(2-3-11(12)20)9-18-4-6-19(7-5-18)13(21)14(15,16)17/h2-3,8,20H,4-7,9H2,1H3
InChIKey DTOHFIKVIZTCRY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 318.296 g/mol
SMILES c1(cc(CN2CCN(CC2)C(=O)C(F)(F)F)ccc1O)OC
SPLASH splash10-000i-3900000000-123172bc69655507fa46
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.
Sample Preparation Procedure Detected: U+UHYTFA
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Benzylpiperazine-M (HO-methoxy-) TFA Fipexide-M (HO-methoxy-BZP) TFA MDBP-M (demethylenyl-methyl-) TFA
Technique GC/MS
Wiley ID MMPW6e_6570