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English
2-Methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-yl 3-methylbutanoate
chemical compound
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No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
236.177630008
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₄O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
C=C(C)C1CC=C(C)C(OC(=O)CC(C)C)C1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C15H24O2/c1-10(2)8-15(16)17-14-9-13(11(3)4)7-6-12(14)5/h6,10,13-14H,3,7-9H2,1-2,4-5H3
0 references
InChIKey
GGESQBHSIRCDBW-UHFFFAOYSA-N
0 references
CAS Registry Number
94386-39-7
1 reference
InChIKey
GGESQBHSIRCDBW-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
8 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=94386-39-7
PubChem CID
216439
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
GGESQBHSIRCDBW-UHFFFAOYSA-N
UniChem compound ID
50969295
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00869235
1 reference
matched by identifier from
InChIKey
InChIKey
GGESQBHSIRCDBW-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30817249
0 references
FL number
09.870
1 reference
quotation
CAS no.: 94386-39-7
(English)
stated in
EFSA database
retrieved
23 January 2021
FL number
09.870
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