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(Q82781209)
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English
(2S,3R)-2-Decyl-3-(5-methylheptyl)oxirane
chemical compound
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
296.3079159
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₄₀O
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCCCCCCCCC1OC1CCCCC(C)CC
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCCCCCCCC[C@@H]1O[C@@H]1CCCCC(C)CC
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C20H40O/c1-4-6-7-8-9-10-11-12-16-19-20(21-19)17-14-13-15-18(3)5-2/h18-20H,4-17H2,1-3H3/t18?,19-,20+/m0/s1
0 references
InChIKey
LKYWIGBSDIKOFS-NRRUETGQSA-N
0 references
CAS Registry Number
62720-03-0
0 references
PubChem CID
71383500
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
66663564
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00805810
0 references
DSSTOX compound identifier
DTXCID80756553
0 references
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