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3-Chloro-4-methyl-isothiazole
SpectraBase Compound ID C5fDaH7MFTD
InChI InChI=1S/C4H4ClNS/c1-3-2-7-6-4(3)5/h2H,1H3
InChIKey FQANRCWINZEGNW-UHFFFAOYSA-N
Mol Weight 133.6 g/mol
Molecular Formula C4H4ClNS
Exact Mass 132.975298 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LYN1xFih8bQ
Name 3-CHLORO-4-METHYLISOTHIAZOLE
Source of Sample R. Rupprecht, W. Bremser BASF Ludwigshafen (1982)
CAS Registry Number 1072-56-6
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H4ClNS
InChI InChI=1S/C4H4ClNS/c1-3-2-7-6-4(3)5/h2H,1H3
InChIKey FQANRCWINZEGNW-UHFFFAOYSA-N
Molecular Weight 133.60
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WM-360
Synonyms ISOTHIAZOLE, 3-CHLORO-4-METHYL-,