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4,5,6-Trichlorotropolone (4,5,6-trichloro-2-hydroxycyclohepta-2,4,6-trien-1-one)
SpectraBase Compound ID 5nQynpkqode
InChI InChI=1S/C7H3Cl3O2/c8-3-1-5(11)6(12)2-4(9)7(3)10/h1-2H,(H,11,12)
InChIKey BBGRRBURMCPLMB-UHFFFAOYSA-N
Mol Weight 225.46 g/mol
Molecular Formula C7H3Cl3O2
Exact Mass 223.919862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9hQ5Y5MUrrF
Name 4,5,6-Trichlorotropolone (4,5,6-trichloro-2-hydroxycyclohepta-2,4,6-trien-1-one)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3Cl3O2
InChI InChI=1S/C7H3Cl3O2/c8-3-1-5(11)6(12)2-4(9)7(3)10/h1-2H,(H,11,12)
InChIKey BBGRRBURMCPLMB-UHFFFAOYSA-N
Molecular Weight 225.458 g/mol
SMILES OC1=CC(=C(C(=CC1=O)Cl)Cl)Cl
SPLASH splash10-0002-0890000000-10d2c15506c92e94be0f
Source of Spectrum SO-0-955-15
Synonyms 4,5,6-trichloro-2-hydroxycyclohepta-2,4,6-trien-1-one 4,5,6-trichloro-2-hydroxy-1-cyclohepta-2,4,6-trienone 4,5,6-tris(chloranyl)-2-oxidanyl-cyclohepta-2,4,6-trien-1-one
Wiley ID 1539595