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(Q82270897)
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English
Propanedioic acid, (1-oxo-3-phenylpropyl)-, diethyl ester
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
292.13107374
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₆H₂₀O₅
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canonical SMILES
CCOC(=O)C(C(=O)CCC1=CC=CC=C1)C(=O)OCC
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Identifiers
InChI
InChI=1S/C16H20O5/c1-3-20-15(18)14(16(19)21-4-2)13(17)11-10-12-8-6-5-7-9-12/h5-9,14H,3-4,10-11H2,1-2H3
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InChIKey
PGTBZYZSSYPXIS-UHFFFAOYSA-N
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CAS Registry Number
62984-12-7
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PubChem CID
10989977
1 reference
matched by identifier from
InChIKey
InChIKey
PGTBZYZSSYPXIS-UHFFFAOYSA-N
UniChem compound ID
25690996
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00451038
1 reference
matched by identifier from
InChIKey
InChIKey
PGTBZYZSSYPXIS-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20401858
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