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(Q82711142)
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English
Methyl 2-(hexa-2,4-diyn-1-yl)benzoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
212.083729624
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₁₂O₂
0 references
canonical SMILES
CC#CC#CCC1=CC=CC=C1C(=O)OC
0 references
found in taxon
Argyranthemum adauctum
1 reference
stated in
Sesquiterpenes and acetylenes from Argyranthemum adauctum ssp. jacobaeifolium
Identifiers
InChI
InChI=1S/C14H12O2/c1-3-4-5-6-9-12-10-7-8-11-13(12)14(15)16-2/h7-8,10-11H,9H2,1-2H3
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InChIKey
CFAVBZLDDRDITG-UHFFFAOYSA-N
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CAS Registry Number
92632-14-9
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PubChem CID
71329233
1 reference
matched by identifier from
InChIKey
InChIKey
CFAVBZLDDRDITG-UHFFFAOYSA-N
UniChem compound ID
58021445
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00758079
1 reference
matched by identifier from
InChIKey
InChIKey
CFAVBZLDDRDITG-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID10708823
0 references
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