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5-ACETYLAMINO-3-METHYLTHIO-1H-1,2,4-TRIAZOLE

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

5-ACETYLAMINO-3-METHYLTHIO-1H-1,2,4-TRIAZOLE
SpectraBase Compound ID ABJOR8LScMS
InChI InChI=1S/C5H8N4OS/c1-3(10)6-4-7-5(11-2)9-8-4/h1-2H3,(H2,6,7,8,9,10)
InChIKey YGYHRNJXXKFSRT-UHFFFAOYSA-N
Mol Weight 172.21 g/mol
Molecular Formula C5H8N4OS
Exact Mass 172.041882 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EtJBbklpg7W
Name N-(5-(methylthio)-4H-1,2,4-triazol-3-yl)acetamide
Alternate Name(s) N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)acetamide N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)ethanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8N4OS
InChI InChI=1S/C5H8N4OS/c1-3(10)6-4-7-5(11-2)9-8-4/h1-2H3,(H2,6,7,8,9,10)
InChIKey YGYHRNJXXKFSRT-UHFFFAOYSA-N
Molecular Weight 172.206 g/mol
SMILES N(c1nnc(SC)[nH]1)C(C)=O
SPLASH splash10-003v-9300000000-381b070d7ca7dbe93c99
Source of Spectrum JX-2012-521
Wiley ID 1660968