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(Q82374827)
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English
(4R)-4-Hydroxy-4-(2-methoxyphenyl)butan-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
194.094294308
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₁H₁₄O₃
0 references
canonical SMILES
COc1ccccc1C(O)CC(C)=O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(=O)C[C@H](C1=CC=CC=C1OC)O
0 references
Identifiers
InChI
InChI=1S/C11H14O3/c1-8(12)7-10(13)9-5-3-4-6-11(9)14-2/h3-6,10,13H,7H2,1-2H3/t10-/m1/s1
0 references
InChIKey
HCCOOGWHEHRKPQ-SNVBAGLBSA-N
0 references
CAS Registry Number
502630-80-0
0 references
PubChem CID
12990511
1 reference
matched by identifier from
InChIKey
InChIKey
HCCOOGWHEHRKPQ-SNVBAGLBSA-N
UniChem compound ID
45999729
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00514475
1 reference
matched by identifier from
InChIKey
InChIKey
HCCOOGWHEHRKPQ-SNVBAGLBSA-N
DSSTOX compound identifier
DTXCID10465282
0 references
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