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Naratriptan TFA
SpectraBase Compound ID JKMgq8UccYW
InChI InChI=1S/C19H24F3N3O3S/c1-23-29(27,28)10-7-13-3-4-17-15(11-13)16(14-5-8-24(2)9-6-14)12-25(17)18(26)19(20,21)22/h3-4,11-12,14,23H,5-10H2,1-2H3
InChIKey RRVDXMRGKQAMHB-UHFFFAOYSA-N
Mol Weight 431.47 g/mol
Molecular Formula C19H24F3N3O3S
Exact Mass 431.149047 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PxsgDvnYu
Name Naratriptan TFA
Classification Antimigraine
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Exact Mass 431.149047305 u
Formula C19H24N3O3SF3
InChI InChI=1S/C19H24F3N3O3S/c1-23-29(27,28)10-7-13-3-4-17-15(11-13)16(14-5-8-24(2)9-6-14)12-25(17)18(26)19(20,21)22/h3-4,11-12,14,23H,5-10H2,1-2H3
InChIKey RRVDXMRGKQAMHB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 431.474 g/mol
SMILES C(C([n]1cc(c2cc(ccc12)CCS(=O)(NC)=O)C1CCN(CC1)C)=O)(F)(F)F
SPLASH splash10-00di-9200100000-cc78e080e0d67a7dfc97
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_7506