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trans-1-(p-chlorophenyl)-5-[2-(dimethylamino)vinyl]-4-methyl-1H-tetrazolium perchlorate
SpectraBase Compound ID 4Rjm0BAuA1R
InChI InChI=1S/C12H15ClN5.ClHO4/c1-16(2)9-8-12-17(3)14-15-18(12)11-6-4-10(13)5-7-11;2-1(3,4)5/h4-9H,1-3H3;(H,2,3,4,5)/q+1;/p-1
InChIKey KXCPYGOALBSXII-UHFFFAOYSA-M
Mol Weight 364.19 g/mol
Molecular Formula C12H15Cl2N5O4
Exact Mass 363.050109 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2znYZFqVwHT
Name trans-1-(p-chlorophenyl)-5-[2-(dimethylamino)vinyl]-4-methyl-1H-tetrazolium perchlorate
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Formula C12H15Cl2N5O4
InChI InChI=1S/C12H15ClN5.ClHO4/c1-16(2)9-8-12-17(3)14-15-18(12)11-6-4-10(13)5-7-11;2-1(3,4)5/h4-9H,1-3H3;(H,2,3,4,5)/q+1;/p-1
InChIKey KXCPYGOALBSXII-UHFFFAOYSA-M
Instrument Name Varian CFT-20
Sadtler NMR Number 52795M
Solvent DMSO-d6