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Metaclazepam-M (O-demethyl-) AC
SpectraBase Compound ID 7zfObykwNhO
InChI InChI=1S/C19H18BrClN2O2/c1-12(24)25-11-14-10-22-19(15-5-3-4-6-17(15)21)16-9-13(20)7-8-18(16)23(14)2/h3-9,14H,10-11H2,1-2H3
InChIKey OXBORVBWTLIZEM-UHFFFAOYSA-N
Mol Weight 421.72 g/mol
Molecular Formula C19H18BrClN2O2
Exact Mass 420.024019 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AbHFFmoGmIv
Name Metaclazepam-M (O-demethyl-) AC
Classification Tranquilizer
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 420.024018526 u
Formula C19H18BrClN2O2
InChI InChI=1S/C19H18BrClN2O2/c1-12(24)25-11-14-10-22-19(15-5-3-4-6-17(15)21)16-9-13(20)7-8-18(16)23(14)2/h3-9,14H,10-11H2,1-2H3
InChIKey OXBORVBWTLIZEM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 421.722 g/mol
SMILES CC(OCC1CN=C(c2ccccc2Cl)c2c(N1C)ccc(Br)c2)=O
SPLASH splash10-0019-1329100000-75a0693d1cbe6ec31abe
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: U+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_2147