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3-Isopropyl-1,2-cyclopentanedione

PropertiesImage
MNX_IDMNXM117487 Image of MNXM117487
referencechebi:195722
formulaC8H12O2
global charge0
mol weight140.182
InChIKeyQGJSBGJNGUBEKG-UHFFFAOYSA-N
InChIInChI=1S/C8H12O2/c1-5(2)6-3-4-7(9)8(6)10/h5-6H,3-4H2,1-2H3
SMILESCC(C)C1CCC(=O)C1=O
MNX internals
InChI (mnx)InChI=1/C8H12O2/c1-5(2)6-3-4-7(9)8(6)10/h5-6H,3-4H2,1-2H3/t6? Image of MNXM117487
SMILES (mnx)[CH3:1][CH:5]([CH3:2])[CH:6]1[CH2:3][CH2:4][C:7](=[O:9])[C:8]1=[O:10]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:195722
chebi:195722
QGJSBGJNGUBEKG-UHFFFAOYSA-N 		3-Isopropyl-1,2-cyclopentanedione
3-propan-2-ylcyclopentane-1,2-dione
hmdb:HMDB0039681
QGJSBGJNGUBEKG-UHFFFAOYSA-N 		3-Isopropyl-1,2-cyclopentanedione
2-Hydroxy-3-(1-methylethyl)-2-cyclopenten-1-one, 9ci
2-Hydroxy-3-isopropyl-2-cyclopenten-1-one
3-(propan-2-yl)cyclopentane-1,2-dione
3-isopropylcyclopentane-1,2-dione

hmdb:HMDB39681 		secondary/obsolete/fantasy identifier