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OUZCWDMJTKYHCA-UHFFFAOYSA-N

View entire compound with spectra: 9 NMR, 2 FTIR, and 3 MS (GC)

OUZCWDMJTKYHCA-UHFFFAOYSA-N
SpectraBase Compound ID 1CeQ2Jzc160
InChI InChI=1S/C3H5N3S/c1-2-4-3(7)6-5-2/h1H3,(H2,4,5,6,7)
InChIKey OUZCWDMJTKYHCA-UHFFFAOYSA-N
Mol Weight 115.15 g/mol
Molecular Formula C3H5N3S
Exact Mass 115.020418 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 348c07L5hdo
Name 5-methyl-4H-1,2,4-triazole-3-thiol
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 415634
CAS Registry Number 7271-44-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C3H5N3S
InChI InChI=1S/C3H5N3S/c1-2-4-3(7)6-5-2/h1H3,(H2,4,5,6,7)
InChIKey OUZCWDMJTKYHCA-UHFFFAOYSA-N
Observed nucleus 13C
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 5-Methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione 3-Methyl-1H-1,2,4-triazol-5-thiol
Wiley ID SIAL_13CNMR_009194