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1-(1,3-DIPHENYLTETRAZOL-5-YLIO)-3-(3-PHENYL-1,2,3-OXADIAZOL-5-YLIO)-INDENIDE-TRIFLATE

View entire compound with spectra: 1 NMR

1-(1,3-DIPHENYLTETRAZOL-5-YLIO)-3-(3-PHENYL-1,2,3-OXADIAZOL-5-YLIO)-INDENIDE-TRIFLATE
SpectraBase Compound ID 2N6YsVyLkJv
InChI InChI=1S/C30H21N6O.CHF3O3S/c1-4-12-22(13-5-1)34-21-29(37-33-34)27-20-28(26-19-11-10-18-25(26)27)30-31-36(24-16-8-3-9-17-24)32-35(30)23-14-6-2-7-15-23;2-1(3,4)8(5,6)7/h1-21H;(H,5,6,7)/q+1;/p-1
InChIKey DWQJWBADLMIUMP-UHFFFAOYSA-M
Mol Weight 630.6 g/mol
Molecular Formula C31H21F3N6O4S
Exact Mass 630.129709 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I2DS8EzwAcy
Name 1-(1,3-DIPHENYLTETRAZOL-5-YLIO)-3-(3-PHENYL-1,2,3-OXADIAZOL-5-YLIO)-INDENIDE-TRIFLATE
Compound Number 10
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C30H21N6O.CHF3O3S/c1-4-12-22(13-5-1)34-21-29(37-33-34)27-20-28(26-19-11-10-18-25(26)27)30-31-36(24-16-8-3-9-17-24)32-35(30)23-14-6-2-7-15-23;2-1(3,4)8(5,6)7/h1-21H;(H,5,6,7)/q+1;/p-1
InChIKey DWQJWBADLMIUMP-UHFFFAOYSA-M
Literature Reference S.ARAKI,J.MIZUYA,N.AOYAMA,Y.BUTSUGAN J.CHEM.SOC.PERKIN-1,1989(1995)
Solvent Dimethyl sulfoxide-d6