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5-Chloro-2-methyl-3-isothiazolone
SpectraBase Compound ID Km9n19WwbKB
InChI InChI=1S/C4H4ClNOS/c1-6-4(7)2-3(5)8-6/h2H,1H3
InChIKey DHNRXBZYEKSXIM-UHFFFAOYSA-N
Mol Weight 149.59 g/mol
Molecular Formula C4H4ClNOS
Exact Mass 148.970213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3OgjTPeEK0
Name 2,3-Dihydro-2-methyl-3-oxo-5-chloroisothiazole
Alternate Name(s) 3(2H)-Isothiazolone, 5-chloro-2-methyl- 4-Isothiazolin-3-one, 5-chloro-2-methyl- 5-Chloranyl-2-methyl-1,2-thiazol-3-one 5-Chloro-2-methyl-1,2-thiazol-3-one 5-Chloro-2-methyl-isothiazol-3-one 5-Chloro-2-methyl-3-isothiazolone 5-Chloro-2-methyl-2H-isothiazol-3-one 5-Chloro-2-methyl-3(2H)-isothiazolone 5-Chloro-2-methyl-4-isothiazolin-3-one Methylchloroisothiazolinone BRN 1210149 EINECS 247-500-7 KATHON CG 5243
CAS Registry Number 26172-55-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H4ClNOS
InChI InChI=1S/C4H4ClNOS/c1-6-4(7)2-3(5)8-6/h2H,1H3
InChIKey DHNRXBZYEKSXIM-UHFFFAOYSA-N
Molecular Weight 149.595 g/mol
SMILES C=1(Cl)SN(C)C(=O)C1
SPLASH splash10-06ri-9300000000-5c56fed7971bada14a53
Source of Spectrum W5-1989-38406-27130
Wiley ID 1146055