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trans-5-[2-(dimethylamino)vinyl]-1-(p-iodophenyl)-4-methyl-1H-tetrazolium perchlorate
SpectraBase Compound ID 3A4g4Xda4fH
InChI InChI=1S/C12H15IN5.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 FQSLNVMJLAJTLH-UHFFFAOYSA-M
Mol Weight 455.64 g/mol
Molecular Formula C12H15ClIN5O4
Exact Mass 454.985727 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5FsflvQHdLE
Name trans-5-[2-(DIMETHYLAMINO)VINYL]-1-(p-IODOPHENYL)-4-METHYLTETRAZOLIUM 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 C12H15ClIN5O4
InChI InChI=1S/C12H15IN5.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 FQSLNVMJLAJTLH-UHFFFAOYSA-M
Melting Point 209-210C
Molecular Weight 455.64
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms 1H-TETRAZOLIUM PERCHLORATE, 5-/2-/DIMETHYLAMINO/VINYL/-1-/P-IODOPHENYL/-4-METHYL-, trans-,