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Zotepine-M (HO-) AC
SpectraBase Compound ID 5vnzs3KssP1
InChI InChI=1S/C20H20ClNO3S/c1-13(23)25-16-6-4-14-10-18(24-9-8-22(2)3)17-11-15(21)5-7-19(17)26-20(14)12-16/h4-7,10-12H,8-9H2,1-3H3
InChIKey MOYVSSYUSWTHQQ-UHFFFAOYSA-N
Mol Weight 389.9 g/mol
Molecular Formula C20H20ClNO3S
Exact Mass 389.085242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 234Vd0kc4
Name Zotepine-M (HO-) AC
Classification Neuroleptic
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 389.085242379 u
Formula C20H20ClNO3S
InChI InChI=1S/C20H20ClNO3S/c1-13(23)25-16-6-4-14-10-18(24-9-8-22(2)3)17-11-15(21)5-7-19(17)26-20(14)12-16/h4-7,10-12H,8-9H2,1-3H3
InChIKey MOYVSSYUSWTHQQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 389.897 g/mol
SMILES c12C(=Cc3ccc(cc3Sc2ccc(c1)Cl)OC(=O)C)OCCN(C)C
SPLASH splash10-0ab9-9100000000-a636cecc137cd9c253d8
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_4299