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(Q105111746)
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English
2-[(Z)-2-bromoethenyl]-4,4-dimethylcyclohexa-2,5-dien-1-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
ochtodane monoterpenoids
0 references
mass
225.999327072
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₀H₁₁BrO
0 references
canonical SMILES
O=C1C=CC(C=C1C=CBr)(C)C
0 references
isomeric SMILES
CC1(C)C=CC(=O)C(/C=C\Br)=C1
1 reference
based on heuristic
inferred from InChI
found in taxon
Portieria hornemannii
1 reference
stated in
Halogenated Monoterpenes Having a Cyclohexadienone from the Red AlgaPortieria Hornemanni
Identifiers
InChI
InChI=1S/C10H11BrO/c1-10(2)5-3-9(12)8(7-10)4-6-11/h3-7H,1-2H3/b6-4-
0 references
InChIKey
IEGFKNRRZZTJIU-XQRVVYSFSA-N
0 references
PubChem CID
21776858
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IEGFKNRRZZTJIU-XQRVVYSFSA-N
UniChem compound ID
60269141
1 reference
stated in
UniChem
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