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1-methyl-1H-tetrazole-5-thiol

View entire compound with spectra: 9 NMR, 2 FTIR, and 1 MS (GC)

1-methyl-1H-tetrazole-5-thiol
SpectraBase Compound ID 34S38SST4MP
InChI InChI=1S/C2H4N4S/c1-6-2(7)3-4-5-6/h1H3,(H,3,5,7)
InChIKey XOHZHMUQBFJTNH-UHFFFAOYSA-N
Mol Weight 116.14 g/mol
Molecular Formula C2H4N4S
Exact Mass 116.015667 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JovMCkwMMy2
Name 5-Mercapto-1-methyltetrazole
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 357871
CAS Registry Number 13183-79-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C2H4N4S
InChI InChI=1S/C2H4N4S/c1-6-2(7)3-4-5-6/h1H3,(H,3,5,7)
InChIKey XOHZHMUQBFJTNH-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_007371