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Oxyphenbutazone TMS
SpectraBase Compound ID 7TukTMhyJlf
InChI InChI=1S/C22H28N2O3Si/c1-5-6-12-20-21(25)23(17-10-8-7-9-11-17)24(22(20)26)18-13-15-19(16-14-18)27-28(2,3)4/h7-11,13-16,20H,5-6,12H2,1-4H3
InChIKey KIVVSRRCOMXDAA-UHFFFAOYSA-N
Mol Weight 396.56 g/mol
Molecular Formula C22H28N2O3Si
Exact Mass 396.186919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHERrYJ5FkO
Name Oxyphenbutazone TMS
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 396.186919302 u
Formula C22H28N2O3Si
InChI InChI=1S/C22H28N2O3Si/c1-5-6-12-20-21(25)23(17-10-8-7-9-11-17)24(22(20)26)18-13-15-19(16-14-18)27-28(2,3)4/h7-11,13-16,20H,5-6,12H2,1-4H3
InChIKey KIVVSRRCOMXDAA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 396.562 g/mol
Nominal Mass 396 u
Quality 922
Retention Index 2689
SMILES C1(N(N(C(C1CCCC)=O)C=1C=CC(=CC1)O[Si](C)(C)C)C=1C=CC=CC1)=O
SPLASH splash10-05fs-9873000000-6463d1c5c3326282f310
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-butyl-1-phenyl-2-(4-((trimethylsilyl)oxy)phenyl)pyrazolidine-3,5-dione
Technique GC/MS
Wiley ID DD2024_006500