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Zotepine-M (HO-) isomer-1 HY    @
SpectraBase Compound ID 6cMH4T3YSLm
InChI InChI=1S/C14H9ClO2S/c15-9-2-4-13-11(6-9)12(17)5-8-1-3-10(16)7-14(8)18-13/h1-7,16-17H
InChIKey XBTLHABBTYEOCS-UHFFFAOYSA-N
Mol Weight 276.74 g/mol
Molecular Formula C14H9ClO2S
Exact Mass 276.001178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9YJO7mdeN3o
Name Zotepine-M (HO-) isomer-2 HY @
Classification Neuroleptic
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 276.001178402 u
Formula C14H9ClO2S
InChI InChI=1S/C14H9ClO2S/c15-9-2-4-13-11(6-9)12(17)5-8-1-3-10(16)7-14(8)18-13/h1-7,16-17H
InChIKey XBTLHABBTYEOCS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 276.737 g/mol
SMILES C=1(c2c(ccc(c2)Cl)Sc2c(C1)ccc(c2)O)O
SPLASH splash10-004i-2390000000-e2d7acab391f5fb7deaa
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: UHY
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-) isomer-2 HY Zotepine-M (nor-HO-) isomer-2 HY
Technique GC/MS
Wiley ID MMPW6e_4297