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4-Bromo-3-chloro-5-phenyl-isothiazole

View entire compound with spectra: 1 MS (GC)

4-Bromo-3-chloro-5-phenyl-isothiazole
SpectraBase Compound ID 5O4ktDPzU0O
InChI InChI=1S/C9H5BrClNS/c10-7-8(13-12-9(7)11)6-4-2-1-3-5-6/h1-5H
InChIKey IBQVALRKFZKLNY-UHFFFAOYSA-N
Mol Weight 274.56 g/mol
Molecular Formula C9H5BrClNS
Exact Mass 272.901461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8a5neUjypyL
Name 4-Bromo-3-chloro-5-phenyl-isothiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H5BrClNS
InChI InChI=1S/C9H5BrClNS/c10-7-8(13-12-9(7)11)6-4-2-1-3-5-6/h1-5H
InChIKey IBQVALRKFZKLNY-UHFFFAOYSA-N
Molecular Weight 274.563 g/mol
SMILES c1(c(snc1Cl)-c1ccccc1)Br
SPLASH splash10-004i-2690000000-ac41651de0ecf99c8bb9
Source of Spectrum F5-5-1387-5
Synonyms 4-Bromo-3-chloro-5-phenylisothiazole 4-Bromo-3-chloro-5-phenyl-1,2-thiazole 4-Bromanyl-3-chloranyl-5-phenyl-1,2-thiazole
Wiley ID 1733208