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Pecazine
SpectraBase Compound ID 3gvjfNCcjS5
InChI InChI=1S/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3
InChIKey CBHCDHNUZWWAPP-UHFFFAOYSA-N
Mol Weight 310.46 g/mol
Molecular Formula C19H22N2S
Exact Mass 310.15037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GnNcbuJTG6b
Name Pecazine
CAS Registry Number 60-89-9
Classification Neuroleptic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 310.150369890 u
Formula C19H22N2S
InChI InChI=1S/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3
InChIKey CBHCDHNUZWWAPP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 310.459 g/mol
SMILES C1(CN(CCC1)C)CN1c2c(Sc3ccccc13)cccc2
SPLASH splash10-03dj-6922000000-d575a31ea46ee2814761
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.
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_369