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1,3-BIS-(1,3-DIPHENYLTETRAZOL-5-YLIO)-INDENIDE-TRIFLATE
SpectraBase Compound ID Fgag0PKHHRG
InChI InChI=1S/C35H25N8.CHF3O3S/c1-5-15-26(16-6-1)40-34(36-42(38-40)28-19-9-3-10-20-28)32-25-33(31-24-14-13-23-30(31)32)35-37-43(29-21-11-4-12-22-29)39-41(35)27-17-7-2-8-18-27;2-1(3,4)8(5,6)7/h1-25H;(H,5,6,7)/q+1;/p-1
InChIKey OAVVVTVHBUCXQD-UHFFFAOYSA-M
Mol Weight 706.7 g/mol
Molecular Formula C36H25F3N8O3S
Exact Mass 706.172242 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D5F4tocgeIi
Name 1,3-BIS-(1,3-DIPHENYLTETRAZOL-5-YLIO)-INDENIDE-TRIFLATE
Compound Number 8
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C35H25N8.CHF3O3S/c1-5-15-26(16-6-1)40-34(36-42(38-40)28-19-9-3-10-20-28)32-25-33(31-24-14-13-23-30(31)32)35-37-43(29-21-11-4-12-22-29)39-41(35)27-17-7-2-8-18-27;2-1(3,4)8(5,6)7/h1-25H;(H,5,6,7)/q+1;/p-1
InChIKey OAVVVTVHBUCXQD-UHFFFAOYSA-M
Literature Reference S.ARAKI,J.MIZUYA,N.AOYAMA,Y.BUTSUGAN J.CHEM.SOC.PERKIN-1,1989(1995)
Solvent Dimethyl sulfoxide-d6