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Methadone-M (HO-) AC
SpectraBase Compound ID FUSeTvanJKW
InChI InChI=1S/C23H29NO3/c1-6-22(26)23(16-17(2)24(4)5,19-10-8-7-9-11-19)20-12-14-21(15-13-20)27-18(3)25/h7-15,17H,6,16H2,1-5H3
InChIKey IFRRDZXQOBSXTO-UHFFFAOYSA-N
Mol Weight 367.49 g/mol
Molecular Formula C23H29NO3
Exact Mass 367.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKFyuf6RrWx
Name Methadone-M (HO-) AC
Classification Potent analgesic
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 367.214743795 u
Formula C23H29NO3
InChI InChI=1S/C23H29NO3/c1-6-22(26)23(16-17(2)24(4)5,19-10-8-7-9-11-19)20-12-14-21(15-13-20)27-18(3)25/h7-15,17H,6,16H2,1-5H3
InChIKey IFRRDZXQOBSXTO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 367.489 g/mol
SMILES C(CC)(=O)C(c1ccc(OC(C)=O)cc1)(CC(N(C)C)C)c1ccccc1
SPLASH splash10-00di-9350000000-8e6c7618347a5075131b
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: UHYAC
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_6026