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trans-1-(p-chlorophenyl)-5-[2-(dimethylamino)vinyl]-4-ethyl-1H-tetrazolium perchlorate
SpectraBase Compound ID EjP9BVMAzDy
InChI InChI=1S/C13H17ClN5.ClHO4/c1-4-18-13(9-10-17(2)3)19(16-15-18)12-7-5-11(14)6-8-12;2-1(3,4)5/h5-10H,4H2,1-3H3;(H,2,3,4,5)/q+1;/p-1
InChIKey XVCHGGCIBKXNCW-UHFFFAOYSA-M
Mol Weight 378.22 g/mol
Molecular Formula C13H17Cl2N5O4
Exact Mass 377.065759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2XDNPwQqQ6S
Name trans-1-(p-CHLOROPHENYL)-5-[2-(DIMETHYLAMINO)VINYL]-4-ETHYL-1H-TETRAZOLIUM PERCHLORATE
Source of Sample G. W. Fischer, Academy of Sciences, Leipzig, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17Cl2N5O4
InChI InChI=1S/C13H17ClN5.ClHO4/c1-4-18-13(9-10-17(2)3)19(16-15-18)12-7-5-11(14)6-8-12;2-1(3,4)5/h5-10H,4H2,1-3H3;(H,2,3,4,5)/q+1;/p-1
InChIKey XVCHGGCIBKXNCW-UHFFFAOYSA-M
Melting Point 126-127C
Molecular Weight 378.22
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms 1H-TETRAZOLIUM PERCHLORATE, 1-/P-CHLOROPHENYL/-5-/2-/DIMETHYLAMINO/VINYL/-4-ETHYL-, trans-,