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5-Isopropyl-2-(2-methylpropyl)-2-cyclohexen-1-one

PropertiesImage
MNX_IDMNXM118247 Image of MNXM118247
referencechebi:188972
formulaC13H22O
global charge0
mol weight194.318
InChIKeyRRVUWHZNUXPZBP-UHFFFAOYSA-N
InChIInChI=1S/C13H22O/c1-9(2)7-12-6-5-11(10(3)4)8-13(12)14/h6,9-11H,5,7-8H2,1-4H3
SMILESCC(C)CC1=CCC(C(C)C)CC1=O
MNX internals
InChI (mnx)InChI=1/C13H22O/c1-9(2)7-12-6-5-11(10(3)4)8-13(12)14/h6,9-11H,5,7-8H2,1-4H3/t11? Image of MNXM118247
SMILES (mnx)[CH3:1][CH:9]([CH3:2])[CH2:7][C:12]1=[CH:6][CH2:5][CH:11]([CH:10]([CH3:3])[CH3:4])[CH2:8][C:13]1=[O:14]
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:188972
chebi:188972
RRVUWHZNUXPZBP-UHFFFAOYSA-N 		5-Isopropyl-2-(2-methylpropyl)-2-cyclohexen-1-one
2-(2-methylpropyl)-5-propan-2-ylcyclohex-2-en-1-one
hmdb:HMDB0038216
RRVUWHZNUXPZBP-UHFFFAOYSA-N 		5-Isopropyl-2-(2-methylpropyl)-2-cyclohexen-1-one
2-(2-methylpropyl)-5-(propan-2-yl)cyclohex-2-en-1-one
5-(1-Methylethyl)-2-(2-methylpropyl)-2-cyclohexen-1-one, 9ci
5-isopropyl-2-(2-methylpropyl)cyclohex-2-en-1-one

hmdb:HMDB38216 		secondary/obsolete/fantasy identifier