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Pipamperone 2TMS
SpectraBase Compound ID LNMWDRvVD6g
InChI InChI=1S/C27H46FN3O2Si2/c1-34(2,3)29-26(32)27(31-19-8-7-9-20-31)16-21-30(22-17-27)18-10-11-25(33-35(4,5)6)23-12-14-24(28)15-13-23/h11-15H,7-10,16-22H2,1-6H3,(H,29,32)/b25-11-
InChIKey TYBLITPQEZGSNQ-GATIEOLUSA-N
Mol Weight 519.9 g/mol
Molecular Formula C27H46FN3O2Si2
Exact Mass 519.311259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWr7Ukkvnai
Name Pipamperone 2TMS
Classification Pharmaceutical drug, tranquiliser
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 519.311258964 u
Formula C27H46FN3O2Si2
InChI InChI=1S/C27H46FN3O2Si2/c1-34(2,3)29-26(32)27(31-19-8-7-9-20-31)16-21-30(22-17-27)18-10-11-25(33-35(4,5)6)23-12-14-24(28)15-13-23/h11-15H,7-10,16-22H2,1-6H3,(H,29,32)/b25-11-
InChIKey TYBLITPQEZGSNQ-GATIEOLUSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 519.852 g/mol
Nominal Mass 519 u
Quality 995
Retention Index 3078
SMILES C1(C(N[Si](C)(C)C)=O)(N2CCCCC2)CCN(CC1)CC\C=C\(C=1C=CC(=CC1)F)O[Si](C)(C)C
SPLASH splash10-0229-6970100000-7dcbdb7a25a814993d36
Sample Comments TMS position uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1'-((3Z)-4-(4-fluorophenyl)-4-((trimethylsilyl)oxy)but-3-en-1-yl)-N-(trimethylsilyl)[1,4'-bipiperidine]-4'-\rcarboxamide
Technique GC/MS
Wiley ID DD2024_009827