Concept information
Preferred term
2-[1-(2,6-dioxocyclohexyl)-3-phenylprop-2-ynyl]cyclohexane-1,3-dione
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C21H20O4
inchi
- InChI=1S/C21H20O4/c22-16-8-4-9-17(23)20(16)15(13-12-14-6-2-1-3-7-14)21-18(24)10-5-11-19(21)25/h1-3,6-7,15,20-21H,4-5,8-11H2
inchikey
- FOSKRCKJJPKJBP-UHFFFAOYSA-N
mass
- 336.382
monoisotopicmass
- 336.13616
smiles
- C1CC(=O)C(C(=O)C1)C(C#CC2=CC=CC=C2)C3C(=O)CCCC3=O
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:93997
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