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Almotriptan TMS
SpectraBase Compound ID KeDwcVlYlh8
InChI InChI=1S/C20H33N3O2SSi/c1-21(2)13-10-18-15-23(27(3,4)5)20-9-8-17(14-19(18)20)16-26(24,25)22-11-6-7-12-22/h8-9,14-15H,6-7,10-13,16H2,1-5H3
InChIKey YYZLGYCKIXURAS-UHFFFAOYSA-N
Mol Weight 407.6 g/mol
Molecular Formula C20H33N3O2SSi
Exact Mass 407.206275 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 35VBKK6q1Y
Name Almotriptan TMS
Classification Antimigraine
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Exact Mass 407.206275022 u
Formula C20H33N3O2SSi
InChI InChI=1S/C20H33N3O2SSi/c1-21(2)13-10-18-15-23(27(3,4)5)20-9-8-17(14-19(18)20)16-26(24,25)22-11-6-7-12-22/h8-9,14-15H,6-7,10-13,16H2,1-5H3
InChIKey YYZLGYCKIXURAS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 407.648 g/mol
SMILES CN(C)CCc1c2c([n](c1)[Si](C)(C)C)ccc(CS(=O)(=O)N1CCCC1)c2
SPLASH splash10-0a4i-9000000000-8003c0fe810f8e2588c1
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_8504