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RIZATRIPTAN_BENZOATE;N,N-DIMETHYL-5-(1-H-1,2,4-TRIAZOL-1-YLMETHYL)-1-H-INDOLE-3-ETHANAMINEMONOBENZOATE

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RIZATRIPTAN_BENZOATE;N,N-DIMETHYL-5-(1-H-1,2,4-TRIAZOL-1-YLMETHYL)-1-H-INDOLE-3-ETHANAMINEMONOBENZOATE
SpectraBase Compound ID GEJJkDZqyNK
InChI InChI=1S/C15H19N5.C7H6O2/c1-19(2)6-5-13-8-17-15-4-3-12(7-14(13)15)9-20-11-16-10-18-20;8-7(9)6-4-2-1-3-5-6/h3-4,7-8,10-11,17H,5-6,9H2,1-2H3;1-5H,(H,8,9)
InChIKey JPRXYLQNJJVCMZ-UHFFFAOYSA-N
Mol Weight 391.47 g/mol
Molecular Formula C22H25N5O2
Exact Mass 391.200825 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BPI1hJZH4rG
Name RIZATRIPTAN_BENZOATE;N,N-DIMETHYL-5-(1-H-1,2,4-TRIAZOL-1-YLMETHYL)-1-H-INDOLE-3-ETHANAMINEMONOBENZOATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H25N5O2
InChI InChI=1S/C15H19N5.C7H6O2/c1-19(2)6-5-13-8-17-15-4-3-12(7-14(13)15)9-20-11-16-10-18-20;8-7(9)6-4-2-1-3-5-6/h3-4,7-8,10-11,17H,5-6,9H2,1-2H3;1-5H,(H,8,9)
InChIKey JPRXYLQNJJVCMZ-UHFFFAOYSA-N
Literature Reference Author T.J.S.RAJ,C.BHARATHI,M.S.KUMAR,J.PRABAHAR,P.N.KUMAR,H.K.SHAR MAK.PARIKH
Literature Reference Citation J.PHARM.BIOM.ANAL.,49,156(2009)
Literature Reference DOI 10.1016/j.jpba.2008.10.010
Molecular Weight 391.473 g/mol
Solvent DMSO-D6
Source File Reference UWMZ44240