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Carazolol TMSTFA
SpectraBase Compound ID 4AoWamgrw6U
InChI InChI=1S/C23H29F3N2O3Si/c1-15(2)28(22(29)23(24,25)26)13-16(31-32(3,4)5)14-30-20-12-8-11-19-21(20)17-9-6-7-10-18(17)27-19/h6-12,15-16,27H,13-14H2,1-5H3
InChIKey LGZCRNLAFQKSOI-UHFFFAOYSA-N
Mol Weight 466.58 g/mol
Molecular Formula C23H29F3N2O3Si
Exact Mass 466.189954 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1h4aEQkH1E
Name Carazolol TMSTFA
Classification Beta-Blocker
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Exact Mass 466.189953823 u
Formula C23H29F3N2O3Si
InChI InChI=1S/C23H29F3N2O3Si/c1-15(2)28(22(29)23(24,25)26)13-16(31-32(3,4)5)14-30-20-12-8-11-19-21(20)17-9-6-7-10-18(17)27-19/h6-12,15-16,27H,13-14H2,1-5H3
InChIKey LGZCRNLAFQKSOI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 466.576 g/mol
SMILES c1c2c(ccc1)[nH]c1c2c(ccc1)OCC(CN(C(=O)C(F)(F)F)C(C)C)O[Si](C)(C)C
SPLASH splash10-003r-3960100000-8dc65dba5250b16b7632
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_6178