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N-[2'-N'-(Isoropylcarbamoyl)ethyl]-1,2-benzisothiazol-3(2H)-one
SpectraBase Compound ID HsDVR3qrHg4
InChI InChI=1S/C13H16N2O3S/c1-9(2)14-13(17)18-8-7-15-12(16)10-5-3-4-6-11(10)19-15/h3-6,9H,7-8H2,1-2H3,(H,14,17)
InChIKey VSDNRRANHHCOOL-UHFFFAOYSA-N
Mol Weight 280.34 g/mol
Molecular Formula C13H16N2O3S
Exact Mass 280.088164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 47BqeO6stYt
Name N-[2'-N'-(Isoropylcarbamoyl)ethyl]-1,2-benzisothiazol-3(2H)-one
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Formula C13H16N2O3S
InChI InChI=1S/C13H16N2O3S/c1-9(2)14-13(17)18-8-7-15-12(16)10-5-3-4-6-11(10)19-15/h3-6,9H,7-8H2,1-2H3,(H,14,17)
InChIKey VSDNRRANHHCOOL-UHFFFAOYSA-N
Molecular Weight 280.342 g/mol
SMILES N(C(OCCN1C(c2ccccc2S1)=O)=O)C(C)C
SPLASH splash10-004i-0900000000-234d843ab466ecb393e9
Source of Spectrum D8-329-423-5
Synonyms N-propan-2-ylcarbamic acid 2-(3-oxo-1,2-benzothiazol-2-yl)ethyl ester 2-(3-oxo-1,2-benzothiazol-2-yl)ethyl N-propan-2-ylcarbamate 2-(3-oxo-1,2-benzothiazol-2-yl)ethyl N-isopropylcarbamate 2-(3-oxidanylidene-1,2-benzothiazol-2-yl)ethyl N-propan-2-ylcarbamate
Wiley ID 1516234