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Thioridazine-M 2AC
SpectraBase Compound ID AWRXoBsJmi9
InChI InChI=1S/C24H28N2O3S2/c1-16(27)26-15-19(29-17(2)28)9-8-18(26)12-13-25-21-6-4-5-7-23(21)31-24-11-10-20(30-3)14-22(24)25/h4-7,10-11,14,18-19H,8-9,12-13,15H2,1-3H3
InChIKey OGJQHIQKDADOND-UHFFFAOYSA-N
Mol Weight 456.62 g/mol
Molecular Formula C24H28N2O3S2
Exact Mass 456.154135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IoqrP60EgyA
Name Thioridazine-M 2AC
Classification Neuroleptic
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 456.154135115 u
Formula C24H28N2O3S2
InChI InChI=1S/C24H28N2O3S2/c1-16(27)26-15-19(29-17(2)28)9-8-18(26)12-13-25-21-6-4-5-7-23(21)31-24-11-10-20(30-3)14-22(24)25/h4-7,10-11,14,18-19H,8-9,12-13,15H2,1-3H3
InChIKey OGJQHIQKDADOND-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 456.619 g/mol
SMILES C1(CCC(OC(=O)C)CN1C(=O)C)CCN1c2cc(ccc2Sc2c1cccc2)SC
SPLASH splash10-08fr-4791100000-84805ccda0315d3de770
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 Thioridazine-M (nor-HO-piperidyl-) 2AC
Technique GC/MS
Wiley ID MMPW6e_1894