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Eletriptan TMS
SpectraBase Compound ID JwTjl9Fk2hl
InChI InChI=1S/C25H34N2O2SSi/c1-26-15-8-9-22(26)18-21-19-27(31(2,3)4)25-13-12-20(17-24(21)25)14-16-30(28,29)23-10-6-5-7-11-23/h5-7,10-13,17,19,22H,8-9,14-16,18H2,1-4H3
InChIKey WDWSLUOFHXDNCU-UHFFFAOYSA-N
Mol Weight 454.7 g/mol
Molecular Formula C25H34N2O2SSi
Exact Mass 454.211026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1sdOgk7dYmT
Name Eletriptan TMS
Classification Antimigraine
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 454.211026050 u
Formula C25H34N2O2SSi
InChI InChI=1S/C25H34N2O2SSi/c1-26-15-8-9-22(26)18-21-19-27(31(2,3)4)25-13-12-20(17-24(21)25)14-16-30(28,29)23-10-6-5-7-11-23/h5-7,10-13,17,19,22H,8-9,14-16,18H2,1-4H3
InChIKey WDWSLUOFHXDNCU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 454.704 g/mol
SMILES c1cc(ccc1)S(=O)(=O)CCc1ccc2c(c(c[n]2[Si](C)(C)C)CC2CCCN2C)c1
SPLASH splash10-001i-9000000000-7410142e753c0de26f93
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_7492