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Zotepine-M (HO-) HY2AC        @
SpectraBase Compound ID KDTVbZCHGN0
InChI InChI=1S/C18H13ClO4S/c1-10(20)22-14-5-3-12-7-16(23-11(2)21)15-8-13(19)4-6-17(15)24-18(12)9-14/h3-9H,1-2H3
InChIKey YBYSDBDGNGDOEM-UHFFFAOYSA-N
Mol Weight 360.81 g/mol
Molecular Formula C18H13ClO4S
Exact Mass 360.022308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zsPCtJVOS
Name Zotepine-M (HO-) HY2AC @
Classification Neuroleptic
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 360.022307769 u
Formula C18H13ClO4S
InChI InChI=1S/C18H13ClO4S/c1-10(20)22-14-5-3-12-7-16(23-11(2)21)15-8-13(19)4-6-17(15)24-18(12)9-14/h3-9H,1-2H3
InChIKey YBYSDBDGNGDOEM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 360.811 g/mol
SMILES C=1(c2c(Sc3c(C1)ccc(c3)OC(=O)C)ccc(c2)Cl)OC(=O)C
SPLASH splash10-004i-0293000000-09c8baa0cb3e0828d906
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 Zotepine-M (bis-nor-HO-) HY2AC Zotepine-M (nor-HO-) HY2AC
Technique GC/MS
Wiley ID MMPW6e_4294