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English
(2R)-2-(2-tert-Butoxy-2-oxoethyl)-5-phenylpentanoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
291.16018279591003
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₇H₂₃O₄⁻
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(C)(C)OC(=O)CC(CCCc1ccccc1)C(=O)[O-]
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(C)(C)OC(=O)C[C@@H](CCCC1=CC=CC=C1)C(=O)[O-]
0 references
Identifiers
InChI
InChI=1S/C17H24O4/c1-17(2,3)21-15(18)12-14(16(19)20)11-7-10-13-8-5-4-6-9-13/h4-6,8-9,14H,7,10-12H2,1-3H3,(H,19,20)/p-1/t14-/m1/s1
0 references
InChIKey
BLLMQOGLBBYQOS-CQSZACIVSA-M
0 references
CAS Registry Number
156109-64-7
0 references
PubChem CID
59909815
1 reference
matched by identifier from
InChIKey
InChIKey
BLLMQOGLBBYQOS-CQSZACIVSA-M
UniChem compound ID
54967972
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60733307
1 reference
matched by identifier from
InChIKey
InChIKey
BLLMQOGLBBYQOS-CQSZACIVSA-M
DSSTOX compound identifier
DTXCID50684051
0 references
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