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

*Links on SpectraBase are not permalinks.
PVP-M (carboxy-oxo-) 2TFA
SpectraBase Compound ID E8lN1ea8UGD
InChI InChI=1S/C17H18F3NO5/c1-11(22)10-13(15(25)12-6-3-2-4-7-12)21(9-5-8-14(23)24)16(26)17(18,19)20/h2-4,6-7,13H,5,8-10H2,1H3,(H,23,24)
InChIKey PUFVLGTUFUNSGJ-UHFFFAOYSA-N
Mol Weight 373.33 g/mol
Molecular Formula C17H18F3NO5
Exact Mass 373.113707 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 4MUwixMiQ4
Name PVP-M (carboxy-oxo-) 2TFA
Classification Designer drug
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 373.113707168 u
Formula C17H18NO5F3
InChI InChI=1S/C17H18F3NO5/c1-11(22)10-13(15(25)12-6-3-2-4-7-12)21(9-5-8-14(23)24)16(26)17(18,19)20/h2-4,6-7,13H,5,8-10H2,1H3,(H,23,24)
InChIKey PUFVLGTUFUNSGJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 373.328 g/mol
SMILES c1cc(ccc1)C(=O)C(CC(C)=O)N(CCCC(=O)O)C(=O)C(F)(F)F
SPLASH splash10-05n0-7890000000-be67b5ca83ae8c4a755b
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: UGLUCSPETFA
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Pyrrolidinovalerophenone-M (carboxy-oxo-) 2TFA
Technique GC/MS
Wiley ID MMPW6e_7832