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1-(1-Ethyl-prop-1-enyl)-3-methylthio-1H-1,2,4-triazole
SpectraBase Compound ID 5mLAuv2sVEf
InChI InChI=1S/C8H13N3S/c1-4-7(5-2)11-6-9-8(10-11)12-3/h4,6H,5H2,1-3H3/b7-4-
InChIKey CQTBVQNULADDAW-DAXSKMNVSA-N
Mol Weight 183.27 g/mol
Molecular Formula C8H13N3S
Exact Mass 183.083019 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3J8gI4AGYMO
Name 1-(1-Ethyl-prop-1-enyl)-3-methylthio-1H-1,2,4-triazole
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H13N3S
InChI InChI=1S/C8H13N3S/c1-4-7(5-2)11-6-9-8(10-11)12-3/h4,6H,5H2,1-3H3/b7-4-
InChIKey CQTBVQNULADDAW-DAXSKMNVSA-N
Instrument Name Jeol FX-90
Literature Reference C. Yamazaki, M. Sakai, Y. Miyamoto, J. Chem. Soc. Perkin I 1567 (1987).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3