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(Q82557819)
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English
Ethyl 6-(2-fluorophenyl)-6-oxohexanoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
252.116172624
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₄H₁₇FO₃
0 references
canonical SMILES
CCOC(=O)CCCCC(=O)C1=CC=CC=C1F
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Identifiers
InChI
InChI=1S/C14H17FO3/c1-2-18-14(17)10-6-5-9-13(16)11-7-3-4-8-12(11)15/h3-4,7-8H,2,5-6,9-10H2,1H3
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InChIKey
AIBGXZVPIZYRLI-UHFFFAOYSA-N
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CAS Registry Number
898753-38-3
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PubChem CID
24727407
1 reference
matched by identifier from
InChIKey
InChIKey
AIBGXZVPIZYRLI-UHFFFAOYSA-N
UniChem compound ID
23825423
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00645632
1 reference
matched by identifier from
InChIKey
InChIKey
AIBGXZVPIZYRLI-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID10596383
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