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Clomethiazole-M -H2O AC
SpectraBase Compound ID 43PRmqWlORP
InChI InChI=1S/C8H9NO2S/c1-4-7-5(2)9-8(12-7)11-6(3)10/h4H,1H2,2-3H3
InChIKey ZFGPBTHZTNLPAR-UHFFFAOYSA-N
Mol Weight 183.22 g/mol
Molecular Formula C8H9NO2S
Exact Mass 183.0354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 853uprkcmKj
Name Clomethiazole-M -H2O AC
Classification Hypnotic
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Exact Mass 183.035399706 u
Formula C8H9NO2S
InChI InChI=1S/C8H9NO2S/c1-4-7-5(2)9-8(12-7)11-6(3)10/h4H,1H2,2-3H3
InChIKey ZFGPBTHZTNLPAR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 183.225 g/mol
SMILES Cc1nc(OC(C)=O)sc1C=C
SPLASH splash10-004l-4900000000-e7acaf0ec8efae20618f
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
Synonyms Clomethiazole-M (dechloro-di-HO-) -H2O AC
Technique GC/MS
Wiley ID MMPW6e_1461