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1-METHYL-2-PHENYL-2H-PHENANTHRO-[9,10-D]-1,2,3-TRIAZOLIUM-PERCHLORATE

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1-METHYL-2-PHENYL-2H-PHENANTHRO-[9,10-D]-1,2,3-TRIAZOLIUM-PERCHLORATE
SpectraBase Compound ID 9SqEnbs4p1i
InChI InChI=1S/C21H17N3.ClHO4/c1-23-21-19-14-8-6-12-17(19)16-11-5-7-13-18(16)20(21)22-24(23)15-9-3-2-4-10-15;2-1(3,4)5/h2-14,22H,1H3;(H,2,3,4,5)
InChIKey OXFPQKGHRMBMGN-UHFFFAOYSA-N
Mol Weight 411.85 g/mol
Molecular Formula C21H18ClN3O4
Exact Mass 411.098584 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9GA3P5IFHqm
Name 1-METHYL-2-PHENYL-2H-PHENANTHRO-[9,10-D]-1,2,3-TRIAZOLIUM-PERCHLORATE
Compound Number 2AA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H18ClN3O4
InChI InChI=1S/C21H17N3.ClHO4/c1-23-21-19-14-8-6-12-17(19)16-11-5-7-13-18(16)20(21)22-24(23)15-9-3-2-4-10-15;2-1(3,4)5/h2-14,22H,1H3;(H,2,3,4,5)
InChIKey OXFPQKGHRMBMGN-UHFFFAOYSA-N
Literature Reference Author R.N.BUTLER,J.M.MCMAHON,P.D.MCDONALD,C.S.PYNE,S.SCHAMBONY,P.M CARDLE,D.CUNNINGHAM
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1047(1997)
Literature Reference DOI 10.1039/a605770e
Molecular Weight 411.845 g/mol
Solvent Unknown
Source File Reference UWRU9806