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4,5,6-Trichloro-1,3-benzoxazole-2(3H)-thione
SpectraBase Compound ID AODPLURQwIL
InChI InChI=1S/C7H2Cl3NOS/c8-2-1-3-6(5(10)4(2)9)11-7(13)12-3/h1H,(H,11,13)
InChIKey LYAOHUVQTBMDDG-UHFFFAOYSA-N
Mol Weight 254.52 g/mol
Molecular Formula C7H2Cl3NOS
Exact Mass 252.892268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5AmFvOupHRQ
Name 4,5,6-Trichloro-1,3-benzoxazole-2(3H)-thione
Alternate Name(s) 4,5,6-trichloro-3H-1,3-benzoxazole-2-thione 4,5,6-tris(chloranyl)-3H-1,3-benzoxazole-2-thione
CAS Registry Number 55042-37-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H2Cl3NOS
InChI InChI=1S/C7H2Cl3NOS/c8-2-1-3-6(5(10)4(2)9)11-7(13)12-3/h1H,(H,11,13)
InChIKey LYAOHUVQTBMDDG-UHFFFAOYSA-N
Molecular Weight 254.518 g/mol
SMILES N1c2c(OC1=S)cc(c(c2Cl)Cl)Cl
SPLASH splash10-0006-9200000000-e08ef0457b73919788dd
Wiley ID 1468823