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Traxoprodil 3TMS
SpectraBase Compound ID 9ZtApPSq8cb
InChI InChI=1S/C29H49NO3Si3/c1-24(28(32-35(5,6)7)25-16-18-27(19-17-25)31-34(2,3)4)30-22-20-29(21-23-30,33-36(8,9)10)26-14-12-11-13-15-26/h11-19,24,28H,20-23H2,1-10H3
InChIKey VQPMYMRMEZTREY-UHFFFAOYSA-N
Mol Weight 544.0 g/mol
Molecular Formula C29H49NO3Si3
Exact Mass 543.302024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6d2cWPhnFS
Name Traxoprodil 3TMS
Classification Psychotropic drug
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 543.302024044 u
Formula C29H49NO3Si3
InChI InChI=1S/C29H49NO3Si3/c1-24(28(32-35(5,6)7)25-16-18-27(19-17-25)31-34(2,3)4)30-22-20-29(21-23-30,33-36(8,9)10)26-14-12-11-13-15-26/h11-19,24,28H,20-23H2,1-10H3
InChIKey VQPMYMRMEZTREY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 543.970 g/mol
SMILES c1cc(ccc1O[Si](C)(C)C)C(O[Si](C)(C)C)C(C)N1CCC(O[Si](C)(C)C)(CC1)c1ccccc1
SPLASH splash10-00b9-8960000000-4fdbbec410ab4d7fb73d
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_10308