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(Q105141801)
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English
7-[5-(3,3-Dimethyloxiran-2-yl)-3-methylpent-2-enoxy]chromen-2-one
group of stereoisomers with the chemical formula C₁₉H₂₂O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
2,6-dimethyloctane monoterpenoid
1 reference
inferred from
2,6-dimethyloctane monoterpenoid
biogenic coumarin
1 reference
inferred from
biogenic coumarin
mass
314.15180918399994
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₂₂O₄
0 references
canonical SMILES
O=C1OC=2C=C(OCC=C(C)CCC3OC3(C)C)C=CC2C=C1
0 references
Identifiers
InChI
InChI=1S/C19H22O4/c1-13(4-8-17-19(2,3)23-17)10-11-21-15-7-5-14-6-9-18(20)22-16(14)12-15/h5-7,9-10,12,17H,4,8,11H2,1-3H3
0 references
InChIKey
KJDXYWIMMJVFLH-UHFFFAOYSA-N
0 references
PubChem CID
85040269
2 references
stated in
PubChem
retrieved
4 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KJDXYWIMMJVFLH-UHFFFAOYSA-N
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