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Haloperidol TMS
SpectraBase Compound ID 27zI4l4TpaF
InChI InChI=1S/C24H31ClFNO2Si/c1-30(2,3)29-24(20-8-10-21(25)11-9-20)14-17-27(18-15-24)16-4-5-23(28)19-6-12-22(26)13-7-19/h6-13H,4-5,14-18H2,1-3H3
InChIKey GANQAEPVTSXCFF-UHFFFAOYSA-N
Mol Weight 448.05 g/mol
Molecular Formula C24H31ClFNO2Si
Exact Mass 447.179662 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7qeiw8T5iE
Name Haloperidol TMS
Classification Neuroleptic
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Exact Mass 447.179661638 u
Formula C24H31ClFNO2Si
InChI InChI=1S/C24H31ClFNO2Si/c1-30(2,3)29-24(20-8-10-21(25)11-9-20)14-17-27(18-15-24)16-4-5-23(28)19-6-12-22(26)13-7-19/h6-13H,4-5,14-18H2,1-3H3
InChIKey GANQAEPVTSXCFF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 448.053 g/mol
SMILES C1(O[Si](C)(C)C)(CCN(CCCC(c2ccc(cc2)F)=O)CC1)c1ccc(cc1)Cl
SPLASH splash10-0592-6983000000-46b455ec996a42b6c16d
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_4552