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N-[2'-N'-(t-Butylcarbamoyl)ethyl]-1,2-benzisothiazol-3(2H)-thione
SpectraBase Compound ID J15Ki6wEmkc
InChI InChI=1S/C14H18N2O2S2/c1-14(2,3)15-13(17)18-9-8-16-12(19)10-6-4-5-7-11(10)20-16/h4-7H,8-9H2,1-3H3,(H,15,17)
InChIKey IEXYIDDRNDRVMA-UHFFFAOYSA-N
Mol Weight 310.43 g/mol
Molecular Formula C14H18N2O2S2
Exact Mass 310.08097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CV1MjdXd592
Name N-[2'-N'-(t-Butylcarbamoyl)ethyl]-1,2-benzisothiazol-3(2H)-thione
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Formula C14H18N2O2S2
InChI InChI=1S/C14H18N2O2S2/c1-14(2,3)15-13(17)18-9-8-16-12(19)10-6-4-5-7-11(10)20-16/h4-7H,8-9H2,1-3H3,(H,15,17)
InChIKey IEXYIDDRNDRVMA-UHFFFAOYSA-N
Molecular Weight 310.430 g/mol
SMILES N(C(OCCN1C(c2c(cccc2)S1)=S)=O)C(C)(C)C
SPLASH splash10-000f-5901000000-eaa8d2bb11a14ccdda3b
Source of Spectrum D8-329-423-14
Synonyms N-tert-butylcarbamic acid 2-(3-sulfanylidene-1,2-benzothiazol-2-yl)ethyl ester 2-(3-Thioxo-1,2-benzothiazol-2-yl)ethyl N-tert-butylcarbamate 2-(3-Sulfanylidene-1,2-benzothiazol-2-yl)ethyl N-tert-butylcarbamate
Wiley ID 1516223