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(5Z)-5-(4-ISOPROPYLBENZYLIDENE)-7-METHYL-4,5-DIHYDRO-[1,2,4]-TRIAZOLO-[3,4-C]-[1,2,4]-BENZOTRIAZIN-5-IUM-TETRAFLUOROBORATE

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(5Z)-5-(4-ISOPROPYLBENZYLIDENE)-7-METHYL-4,5-DIHYDRO-[1,2,4]-TRIAZOLO-[3,4-C]-[1,2,4]-BENZOTRIAZIN-5-IUM-TETRAFLUOROBORATE
SpectraBase Compound ID F7WfrKkkRVr
InChI InChI=1S/C19H20N5.BF4/c1-13(2)16-7-5-15(6-8-16)11-24-18-10-14(3)4-9-17(18)23-12-20-21-19(23)22-24;2-1(3,4)5/h4-13H,1-3H3,(H,21,22);/q+1;-1/b24-11-;
InChIKey CTZSWAPOVOTDDK-VAYBTIOZSA-N
Mol Weight 405.21 g/mol
Molecular Formula C19H20BF4N5
Exact Mass 405.174788 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CrzGDJ9XSP1
Name (5Z)-5-(4-ISOPROPYLBENZYLIDENE)-7-METHYL-4,5-DIHYDRO-[1,2,4]-TRIAZOLO-[3,4-C]-[1,2,4]-BENZOTRIAZIN-5-IUM-TETRAFLUOROBORATE
Compound Number 5K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H20BF4N5
InChI InChI=1S/C19H20N5.BF4/c1-13(2)16-7-5-15(6-8-16)11-24-18-10-14(3)4-9-17(18)23-12-20-21-19(23)22-24;2-1(3,4)5/h4-13H,1-3H3,(H,21,22);/q+1;-1/b24-11-;
InChIKey CTZSWAPOVOTDDK-VAYBTIOZSA-N
Literature Reference Author C.GROF,G.HEGEDUES,Z.RIEDL,G.HAJOS,O.EGYED,A.CSAMPAI,V.KUDAR, B.STANOVNIK
Literature Reference Citation EUR.J.ORG.CHEM.,3553(2005)
Molecular Weight 405.205 g/mol
Sample ID 30340
Solvent DMSO-D6