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(Q82014829)
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hexyl 2-ethylbutanoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
200.177630008
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₂₄O₂
0 references
canonical SMILES
CCCCCCOC(=O)C(CC)CC
0 references
Identifiers
InChI
InChI=1S/C12H24O2/c1-4-7-8-9-10-14-12(13)11(5-2)6-3/h11H,4-10H2,1-3H3
0 references
InChIKey
SXIUQXQCWYCRQZ-UHFFFAOYSA-N
0 references
CAS Registry Number
79868-50-1
1 reference
InChIKey
SXIUQXQCWYCRQZ-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=79868-50-1
PubChem CID
227875
1 reference
matched by identifier from
InChIKey
InChIKey
SXIUQXQCWYCRQZ-UHFFFAOYSA-N
UniChem compound ID
6647972
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40281078
1 reference
matched by identifier from
InChIKey
InChIKey
SXIUQXQCWYCRQZ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID90232232
0 references
NSC number
20036
0 references
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