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(Q105178890)
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English
1-[4-hydroxy-2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran-5-yl]ethanone
group of stereoisomers with the chemical formula C₁₃H₁₄O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
biogenic benzofuran
1 reference
inferred from
biogenic benzofuran
mass
218.249
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₄O₃
0 references
canonical SMILES
O=C(C1=CC=C2OC(C(=C)C)CC2=C1O)C
0 references
Identifiers
InChI
InChI=1S/C13H14O3/c1-7(2)12-6-10-11(16-12)5-4-9(8(3)14)13(10)15/h4-5,12,15H,1,6H2,2-3H3
0 references
InChIKey
NGFZSKZFASBMBR-UHFFFAOYSA-N
0 references
PubChem CID
12838731
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NGFZSKZFASBMBR-UHFFFAOYSA-N
UniChem compound ID
59084224
1 reference
stated in
UniChem
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