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5-amino-3-methyl-4-isothiazolecarbonitrile
SpectraBase Compound ID jMnyY1W6yQ
InChI InChI=1S/C5H5N3S/c1-3-4(2-6)5(7)9-8-3/h7H2,1H3
InChIKey PJQFZPWSFDVYIF-UHFFFAOYSA-N
Mol Weight 139.18 g/mol
Molecular Formula C5H5N3S
Exact Mass 139.020418 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID u3gdMeCqzE
Name 5-Amino-4-cyano-3-methyl-isothiazole
CAS Registry Number 41808-35-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H5N3S
InChI InChI=1S/C5H5N3S/c1-3-4(2-6)5(7)9-8-3/h7H2,1H3
InChIKey PJQFZPWSFDVYIF-UHFFFAOYSA-N
Instrument Name Bruker WH-90
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6