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HTXTVJSPEAWXRY-UHFFFAOYSA-M

View entire compound with spectra: 2 NMR

HTXTVJSPEAWXRY-UHFFFAOYSA-M
SpectraBase Compound ID 2D6FYC6AfiV
InChI InChI=1S/C3H7N4S.ClH/c1-7-3(8-2)4-5-6-7;/h1-2H3,(H,4,6);1H/q+1;/p-1
InChIKey HTXTVJSPEAWXRY-UHFFFAOYSA-M
Mol Weight 166.63 g/mol
Molecular Formula C3H7ClN4S
Exact Mass 166.007995 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 52oNeZsPnUd
Name HTXTVJSPEAWXRY-UHFFFAOYSA-M
Compound Number 11B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C3H7ClN4S
InChI InChI=1S/C3H7N4S.ClH/c1-7-3(8-2)4-5-6-7;/h1-2H3,(H,4,6);1H/q+1;/p-1
InChIKey HTXTVJSPEAWXRY-UHFFFAOYSA-M
Literature Reference Author W.BOCIAN,J.JAZWINSKI,W.KOZMINSKI,L.STEFANIAK,G.A.WEBB
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1327(1994)
Literature Reference DOI 10.1039/p29940001327
Molecular Weight 166.628 g/mol
Solvent CF3CO2H
Source File Reference UWRU4211