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English
(1R)-1-Butyl-3-ethoxy-3,4-dihydro-1H-2-benzopyran
group of stereoisomers with the chemical formula C₁₅H₂₂O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
234.161979944
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₂O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCCC1OC(OCC)Cc2ccccc21
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCC[C@H]1OC(OCC)Cc2ccccc21
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C15H22O2/c1-3-5-10-14-13-9-7-6-8-12(13)11-15(17-14)16-4-2/h6-9,14-15H,3-5,10-11H2,1-2H3/t14-,15?/m1/s1
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InChIKey
MKMIPNLWBUISSD-GICMACPYSA-N
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CAS Registry Number
920975-96-8
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PubChem CID
71423846
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
68416375
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90842653
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DSSTOX compound identifier
DTXCID10793395
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