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5,6-bis(bromomethyl)-2,1,3-benzothiadiazol
SpectraBase Compound ID 2rGW9Lw1f38
InChI InChI=1S/C8H6Br2N2S/c9-3-5-1-7-8(12-13-11-7)2-6(5)4-10/h1-2H,3-4H2
InChIKey SQUKAHMVGONAIY-UHFFFAOYSA-N
Mol Weight 322.02 g/mol
Molecular Formula C8H6Br2N2S
Exact Mass 319.861845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7MFvhe1VnQX
Name 5,6-bis(bromomethyl)-2,1,3-benzothiadiazol
Alternate Name(s) 5,6-bis(bromomethyl)-2,1,3-benzothiadiazole
CAS Registry Number 24793-63-3
Comments Less than 3 mono-isotopic peaks
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Formula C8H6Br2N2S
InChI InChI=1S/C8H6Br2N2S/c9-3-5-1-7-8(12-13-11-7)2-6(5)4-10/h1-2H,3-4H2
InChIKey SQUKAHMVGONAIY-UHFFFAOYSA-N
Molecular Weight 322.018 g/mol
SMILES c12c(cc(c(c2)CBr)CBr)nsn1
SPLASH splash10-0006-0093000000-8e25d9c3137008cc66aa
Source of Spectrum K-120-1594-6
Wiley ID 1319592