For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzylpiperazine-M (HO-meth.-) HFB    @
SpectraBase Compound ID JTJ5XUNs5HK
InChI InChI=1S/C16H17F7N2O3/c1-28-12-8-10(2-3-11(12)26)9-24-4-6-25(7-5-24)13(27)14(17,18)15(19,20)16(21,22)23/h2-3,8,26H,4-7,9H2,1H3
InChIKey VMTVCUBWCVQJOF-UHFFFAOYSA-N
Mol Weight 418.31 g/mol
Molecular Formula C16H17F7N2O3
Exact Mass 418.11274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 36ZqEUIqfo
Name Benzylpiperazine-M (HO-meth.-) HFB @
Classification Designer drug
Comments Structure comment: Wiggly bond = unknown position of substituent
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 418.112739553 u
Formula C16H17F7N2O3
InChI InChI=1S/C16H17F7N2O3/c1-28-12-8-10(2-3-11(12)26)9-24-4-6-25(7-5-24)13(27)14(17,18)15(19,20)16(21,22)23/h2-3,8,26H,4-7,9H2,1H3
InChIKey VMTVCUBWCVQJOF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 418.312 g/mol
SMILES c1(cc(CN2CCN(CC2)C(=O)C(F)(F)C(F)(F)C(F)(F)F)ccc1O)OC
SPLASH splash10-000i-5920000000-f64867dfefa622ce06b8
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+UHYHFB
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-) HFB Fipexide-M (HO-methoxy-BZP) HFB MDBP-M (demethylenyl-methyl-) HFB
Technique GC/MS
Wiley ID MMPW6e_6575