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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 Dko3R4Cc12m
Name Haloperidol TMS
Classification Pharmaceutical drug derivative
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
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
Nominal Mass 447 u
Quality 971
Retention Index 3273
SMILES C1(C2=CC=C(C=C2)Cl)(O[Si](C)(C)C)CCN(CC1)CCCC(C1=CC=C(C=C1)F)=O
SPLASH splash10-0aba-6893000000-1d294f8276ae1ab04cf3
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-(4-(4-chlorophenyl)-4-((trimethylsilyl)oxy)piperidin-1-yl)-1-(4-fluorophenyl)butan-1-one
Technique GC/MS
Wiley ID DD2024_025681