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2-Benzothiazolecarboxylic acid, 5-chloro-2,3-dihydro-2-methyl-

View entire compound with spectra: 1 MS (GC)

2-Benzothiazolecarboxylic acid, 5-chloro-2,3-dihydro-2-methyl-
SpectraBase Compound ID FE5mWckGSOX
InChI InChI=1S/C9H8ClNO2S/c1-9(8(12)13)11-6-4-5(10)2-3-7(6)14-9/h2-4,11H,1H3,(H,12,13)
InChIKey KPAQQQPSNSPVLT-UHFFFAOYSA-N
Mol Weight 229.68 g/mol
Molecular Formula C9H8ClNO2S
Exact Mass 228.996427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5gS5J0sZAX0
Name 2-Benzothiazolecarboxylic acid, 5-chloro-2,3-dihydro-2-methyl-
Alternate Name(s) 5-Chloro-2-methyl-2,3-dihydrobenzo[d]thiazole-2-carboxylic acid 5-Chloro-2-methyl-2,3-dihydro-1,3-benzothiazole-2-carboxylic acid 5-Chloranyl-2-methyl-3H-1,3-benzothiazole-2-carboxylic acid
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Formula C9H8ClNO2S
InChI InChI=1S/C9H8ClNO2S/c1-9(8(12)13)11-6-4-5(10)2-3-7(6)14-9/h2-4,11H,1H3,(H,12,13)
InChIKey KPAQQQPSNSPVLT-UHFFFAOYSA-N
Molecular Weight 229.681 g/mol
SMILES N1c2c(SC1(C(O)=O)C)ccc(c2)Cl
SPLASH splash10-001r-3900000000-5636c68cc7f98f08a1f2
Source of Spectrum JX-2015-0-839
Wiley ID 1720726