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(Q83046405)
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English
Ethyl 3-(2-methyl-5-pyridyl)-3-oxopropionate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
207.089543276
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₁H₁₃NO₃
0 references
canonical SMILES
CCOC(=O)CC(=O)C1=CN=C(C=C1)C
0 references
Identifiers
InChI
InChI=1S/C11H13NO3/c1-3-15-11(14)6-10(13)9-5-4-8(2)12-7-9/h4-5,7H,3,6H2,1-2H3
0 references
InChIKey
CSTIAWJADKPHBF-UHFFFAOYSA-N
0 references
CAS Registry Number
21683-58-9
1 reference
InChIKey
CSTIAWJADKPHBF-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=21683-58-9
PubChem CID
89013
1 reference
matched by identifier from
InChIKey
InChIKey
CSTIAWJADKPHBF-UHFFFAOYSA-N
UniChem compound ID
26582530
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00176072
1 reference
matched by identifier from
InChIKey
InChIKey
CSTIAWJADKPHBF-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID9098563
0 references
UNII
5C6ZE85DD3
1 reference
matched by identifier from
InChIKey
InChIKey
CSTIAWJADKPHBF-UHFFFAOYSA-N
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