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Clobenzorex-M (HO-methoxy-) 2AC
SpectraBase Compound ID H5nMdTp5MFI
InChI InChI=1S/C21H24ClNO4/c1-14(23(15(2)24)13-18-7-5-6-8-19(18)22)11-17-9-10-20(27-16(3)25)21(12-17)26-4/h5-10,12,14H,11,13H2,1-4H3
InChIKey OFBLIOXFJRCLSD-UHFFFAOYSA-N
Mol Weight 389.88 g/mol
Molecular Formula C21H24ClNO4
Exact Mass 389.139386 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hNyAYg13o
Name Clobenzorex-M (HO-methoxy-) 2AC
Classification Anorectic
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 389.139385953 u
Formula C21H24ClNO4
InChI InChI=1S/C21H24ClNO4/c1-14(23(15(2)24)13-18-7-5-6-8-19(18)22)11-17-9-10-20(27-16(3)25)21(12-17)26-4/h5-10,12,14H,11,13H2,1-4H3
InChIKey OFBLIOXFJRCLSD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 389.879 g/mol
SMILES c1cc(c(CN(C(=O)C)C(Cc2cc(c(OC(=O)C)cc2)OC)C)cc1)Cl
SPLASH splash10-02vi-0930000000-53dbee85340d62fe4a6a
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_4414