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4-Bromo-5-ethylthieno[3,2-d]isothiazole
SpectraBase Compound ID 5aNkOC8l79T
InChI InChI=1S/C7H6BrNS2/c1-2-5-6(8)4-3-9-11-7(4)10-5/h3H,2H2,1H3
InChIKey JZEJGSUANNDVAT-UHFFFAOYSA-N
Mol Weight 248.16 g/mol
Molecular Formula C7H6BrNS2
Exact Mass 246.912505 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5uqTXood8C2
Name 4-Bromo-5-ethylthieno[3,2-d]isothiazole
Alternate Name(s) 4-bromanyl-5-ethyl-thieno[3,2-d][1,2]thiazole 4-bromo-5-ethyl-thien[3,2-d]isothiazole 4-bromo-5-ethylthieno[3,2-d][1,2]thiazole
Comments Less than 3 mono-isotopic peaks
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Formula C7H6BrNS2
InChI InChI=1S/C7H6BrNS2/c1-2-5-6(8)4-3-9-11-7(4)10-5/h3H,2H2,1H3
InChIKey JZEJGSUANNDVAT-UHFFFAOYSA-N
Molecular Weight 248.156 g/mol
SMILES c1nsc2c1c(c(s2)CC)Br
SPLASH splash10-0002-0090000000-cf7182bad766b8616a99
Source of Spectrum F9-1985-158-0
Wiley ID 1565585