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2H-4,6-dimethylpyrido(3,2-d)isothiazolin-3-one

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2H-4,6-dimethylpyrido(3,2-d)isothiazolin-3-one
SpectraBase Compound ID 4igZ4FxoOyf
InChI InChI=1S/C8H8N2OS/c1-4-3-5(2)9-8-6(4)7(11)10-12-8/h3H,1-2H3,(H,10,11)
InChIKey LXCCCCOECARKEZ-UHFFFAOYSA-N
Mol Weight 180.22 g/mol
Molecular Formula C8H8N2OS
Exact Mass 180.035734 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BDAzHq8rEvL
Name isothiazolo[5,4-b]pyridin-3(2H)-one, 4,6-dimethyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 180.035734059 u
Formula C8H8N2OS
InChI InChI=1S/C8H8N2OS/c1-4-3-5(2)9-8-6(4)7(11)10-12-8/h3H,1-2H3,(H,10,11)
InChIKey LXCCCCOECARKEZ-UHFFFAOYSA-N
Molecular Weight 180.225 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14868
Solvent DMSO-d6
Source Vendor ID: NMR/11210493; Lab Info: KE; Lab Number: KE-0103005