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Cyamemazine-M (bis-nor-HO-) 2AC
SpectraBase Compound ID CWnETsklTUj
InChI InChI=1S/C21H21N3O3S/c1-13(11-23-14(2)25)12-24-18-8-16(10-22)4-6-20(18)28-21-7-5-17(9-19(21)24)27-15(3)26/h4-9,13H,11-12H2,1-3H3,(H,23,25)
InChIKey LDBZTRMQSGNFJE-UHFFFAOYSA-N
Mol Weight 395.48 g/mol
Molecular Formula C21H21N3O3S
Exact Mass 395.130363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 59U34154qm
Name Cyamemazine-M (bis-nor-HO-) 2AC
Classification Neuroleptic
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 395.130362719 u
Formula C21H21N3O3S
InChI InChI=1S/C21H21N3O3S/c1-13(11-23-14(2)25)12-24-18-8-16(10-22)4-6-20(18)28-21-7-5-17(9-19(21)24)27-15(3)26/h4-9,13H,11-12H2,1-3H3,(H,23,25)
InChIKey LDBZTRMQSGNFJE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 395.477 g/mol
SMILES CC(CN1c2c(Sc3c1cc(C#N)cc3)ccc(c2)OC(=O)C)CNC(=O)C
SPLASH splash10-01vk-5896000000-dc8faf036acc5ed8a4f5
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: 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_4396