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Clofedanol-M (HO-) -H2O
SpectraBase Compound ID 1N5HjvoMEBT
InChI InChI=1S/C17H18ClNO/c1-19(2)12-11-15(13-7-9-14(20)10-8-13)16-5-3-4-6-17(16)18/h3-11,20H,12H2,1-2H3/b15-11+
InChIKey BLPNFCCYWDOIKF-RVDMUPIBSA-N
Mol Weight 287.79 g/mol
Molecular Formula C17H18ClNO
Exact Mass 287.107692 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IEZHzc945oL
Name Clofedanol-M (HO-) -H2O
Classification Antitussive
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 287.107691903 u
Formula C17H18ClNO
InChI InChI=1S/C17H18ClNO/c1-19(2)12-11-15(13-7-9-14(20)10-8-13)16-5-3-4-6-17(16)18/h3-11,20H,12H2,1-2H3/b15-11+
InChIKey BLPNFCCYWDOIKF-RVDMUPIBSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 287.790 g/mol
SMILES c1(\C(=C\CN(C)C)c2ccc(cc2)O)c(cccc1)Cl
SPLASH splash10-0zfr-7590000000-b3d1d1c05d5ebebd0859
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: UHY
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_1640