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(Q105010319)
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English
(2E,6E,8E)-deca-2,6,8-trien-4-yn-1-yl acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic acyclic ester
0 references
mass
190.099379688
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₄O₂
0 references
canonical SMILES
O=C(OCC=CC#CC=CC=CC)C
0 references
isomeric SMILES
C/C=C/C=C/C#C/C=C/COC(C)=O
1 reference
based on heuristic
inferred from InChI
found in taxon
Grindelia hirsutula
1 reference
stated in
Polyacetylenverbindungen, LXX. Die Acetylenverbindungen der GattungGrindelia W
Xanthocephalum benthamianum
1 reference
stated in
Ein neues diterpen aus Xanthocephalum linearifolium
Grindelia camporum
1 reference
stated in
Polyacetylenverbindungen, LXX. Die Acetylenverbindungen der GattungGrindelia W
Identifiers
InChI
InChI=1S/C12H14O2/c1-3-4-5-6-7-8-9-10-11-14-12(2)13/h3-6,9-10H,11H2,1-2H3/b4-3+,6-5+,10-9+
0 references
InChIKey
GKUKTHQBDFSPNV-UFLWDRGUSA-N
0 references
CAS Registry Number
929-52-2
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
101412964
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GKUKTHQBDFSPNV-UFLWDRGUSA-N
UniChem compound ID
96740508
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID801258872
1 reference
matched by identifier from
InChIKey
InChIKey
GKUKTHQBDFSPNV-UFLWDRGUSA-N
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