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Cetobemidone PFP
SpectraBase Compound ID X924m7kEPo
InChI InChI=1S/C18H20F5NO3/c1-3-14(25)16(8-5-9-24(2)11-16)12-6-4-7-13(10-12)27-15(26)17(19,20)18(21,22)23/h4,6-7,10H,3,5,8-9,11H2,1-2H3
InChIKey VFGWSMLGGGMGHU-UHFFFAOYSA-N
Mol Weight 393.35 g/mol
Molecular Formula C18H20F5NO3
Exact Mass 393.136334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4xIcVVqgj7t
Name Cetobemidone PFP
Classification Potent analgesic
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Exact Mass 393.136334320 u
Formula C18H20F5NO3
InChI InChI=1S/C18H20F5NO3/c1-3-14(25)16(8-5-9-24(2)11-16)12-6-4-7-13(10-12)27-15(26)17(19,20)18(21,22)23/h4,6-7,10H,3,5,8-9,11H2,1-2H3
InChIKey VFGWSMLGGGMGHU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 393.354 g/mol
SMILES C(C(Oc1cc(C2(CN(CCC2)C)C(=O)CC)ccc1)=O)(C(F)(F)F)(F)F
SPLASH splash10-00di-9201000000-1c1987968f80e4881e8c
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: UHYPFP
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_4303