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5-Methylisothiazole
SpectraBase Compound ID 57tRIv9zNwb
InChI InChI=1S/C4H5NS/c1-4-2-3-5-6-4/h2-3H,1H3
InChIKey LBBKWEDRPDGXPM-UHFFFAOYSA-N
Mol Weight 99.15 g/mol
Molecular Formula C4H5NS
Exact Mass 99.01427 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A8oJvmNdHD2
Name 5-Methylisothiazole
CAS Registry Number 693-97-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C4H5NS
InChI InChI=1S/C4H5NS/c1-4-2-3-5-6-4/h2-3H,1H3
InChIKey LBBKWEDRPDGXPM-UHFFFAOYSA-N
Literature Reference Can. J. Chem. 53, 1677 (1975).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Acetone-D6