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Rizatriptan TFA
SpectraBase Compound ID GiPpvI1eYqa
InChI InChI=1S/C17H18F3N5O/c1-23(2)6-5-13-9-25(16(26)17(18,19)20)15-4-3-12(7-14(13)15)8-24-11-21-10-22-24/h3-4,7,9-11H,5-6,8H2,1-2H3
InChIKey QPBQYDSGCMXLJO-UHFFFAOYSA-N
Mol Weight 365.36 g/mol
Molecular Formula C17H18F3N5O
Exact Mass 365.146345 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fSC9R9CcUl
Name Rizatriptan TFA
Classification Serotoninergic
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Exact Mass 365.146344708 u
Formula C17H18F3N5O
InChI InChI=1S/C17H18F3N5O/c1-23(2)6-5-13-9-25(16(26)17(18,19)20)15-4-3-12(7-14(13)15)8-24-11-21-10-22-24/h3-4,7,9-11H,5-6,8H2,1-2H3
InChIKey QPBQYDSGCMXLJO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 365.360 g/mol
SMILES CN(CCc1c[n](C(C(F)(F)F)=O)c2c1cc(C[n]1ncnc1)cc2)C
SPLASH splash10-0a4i-9200000000-059440019c3438b772eb
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_5842