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Tiapride-M (O-demethyl-)
SpectraBase Compound ID chYcEfKj8s
InChI InChI=1S/C14H22N2O4S/c1-4-16(5-2)9-8-15-14(18)12-10-11(21(3,19)20)6-7-13(12)17/h6-7,10,17H,4-5,8-9H2,1-3H3,(H,15,18)
InChIKey SMMXTJMPESFCOQ-UHFFFAOYSA-N
Mol Weight 314.4 g/mol
Molecular Formula C14H22N2O4S
Exact Mass 314.130028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J9eqnqF64lL
Name Tiapride-M (O-demethyl-)
Classification Antiparkinsonian Neuroleptic
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Exact Mass 314.130028366 u
Formula C14H22N2O4S
InChI InChI=1S/C14H22N2O4S/c1-4-16(5-2)9-8-15-14(18)12-10-11(21(3,19)20)6-7-13(12)17/h6-7,10,17H,4-5,8-9H2,1-3H3,(H,15,18)
InChIKey SMMXTJMPESFCOQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 314.400 g/mol
SMILES c1c(c(O)ccc1S(C)(=O)=O)C(=O)NCCN(CC)CC
SPLASH splash10-000i-9100000000-f148439e32748adea3d6
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_1297