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Cocaine-M (benzoylecgonine) PFP
SpectraBase Compound ID 7HRqwmvUy2d
InChI InChI=1S/C19H20F5NO4/c1-25-12-7-8-13(25)15(17(27)28-10-18(20,21)19(22,23)24)14(9-12)29-16(26)11-5-3-2-4-6-11/h2-6,12-15H,7-10H2,1H3
InChIKey LAMCNGOAOXCPDQ-UHFFFAOYSA-N
Mol Weight 421.36 g/mol
Molecular Formula C19H20F5NO4
Exact Mass 421.131249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IR1OejqF5hP
Name Cocaine-M (benzoylecgonine) PFP
Classification Local anesthetic Addictive drug
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Exact Mass 421.131248939 u
Formula C19H20F5NO4
InChI InChI=1S/C19H20F5NO4/c1-25-12-7-8-13(25)15(17(27)28-10-18(20,21)19(22,23)24)14(9-12)29-16(26)11-5-3-2-4-6-11/h2-6,12-15H,7-10H2,1H3
InChIKey LAMCNGOAOXCPDQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 421.364 g/mol
SMILES C12C(C(CC(N2C)CC1)OC(=O)c1ccccc1)C(OCC(C(F)(F)F)(F)F)=O
SPLASH splash10-001i-9100000000-e97fb2acb3d5def866bc
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_4381