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3-PHENYL-5-AMINO-TETRAZOLIUM_TRIFLUOROACETATE
SpectraBase Compound ID 21612oy2K0W
InChI InChI=1S/C7H7N5.C2HF3O2/c8-7-9-11-12(10-7)6-4-2-1-3-5-6;3-2(4,5)1(6)7/h1-5H,(H2,8,10);(H,6,7)
InChIKey QZWOWAWVOBHFOQ-UHFFFAOYSA-N
Mol Weight 275.19 g/mol
Molecular Formula C9H8F3N5O2
Exact Mass 275.063009 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J9M9DsxCpsT
Name 3-PHENYL-5-AMINO-TETRAZOLIUM_TRIFLUOROACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8F3N5O2
InChI InChI=1S/C7H7N5.C2HF3O2/c8-7-9-11-12(10-7)6-4-2-1-3-5-6;3-2(4,5)1(6)7/h1-5H,(H2,8,10);(H,6,7)
InChIKey QZWOWAWVOBHFOQ-UHFFFAOYSA-N
Literature Reference Author L.STEFANIAK,J.JAZWINSKI
Literature Reference Citation CHEM.HET.COMP.,31,1027(1995)
Literature Reference DOI 10.1007/bf01165049
Solvent TFA-D1
Source File Reference UWMZ14941