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3-Bromo-4,6-dimethylisothiazolo[5,4-b]pyridine
SpectraBase Compound ID I6rREJXZV6B
InChI InChI=1S/C8H7BrN2S/c1-4-3-5(2)10-8-6(4)7(9)11-12-8/h3H,1-2H3
InChIKey GQVKRDRDFJTFEZ-UHFFFAOYSA-N
Mol Weight 243.12 g/mol
Molecular Formula C8H7BrN2S
Exact Mass 241.951332 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID uiyh4vdLs
Name 3-Bromo-4,6-dimethylisothiazolo[5,4-b]pyridine
Alternate Name(s) 3-Bromanyl-4,6-dimethyl-[1,2]thiazolo[5,4-b]pyridine 3-Bromo-4,6-dimethyl-[1,2]thiazolo[5,4-b]pyridine Isothiazolo[5,4-b]pyridine, 3-bromo-4,6-dimethyl-
CAS Registry Number 61889-26-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7BrN2S
InChI InChI=1S/C8H7BrN2S/c1-4-3-5(2)10-8-6(4)7(9)11-12-8/h3H,1-2H3
InChIKey GQVKRDRDFJTFEZ-UHFFFAOYSA-N
Molecular Weight 243.122 g/mol
SMILES c1c(nc2c(c1C)c(ns2)Br)C
SPLASH splash10-0006-9640000000-0d5b8ca0a9cf61e7da45
Source of Spectrum AD-0-2532-0
Wiley ID 1432048