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6-isopropenyl-3-methyloxepan-2-one

MNXM6008 is deprecated and here replaced by MNXM1107533
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1107533 Image of MNXM1107533
referencechebi:64229
formulaC10H16O2
global charge0
mol weight168.236
InChIKeyBBKYOZJVRPOMGL-UHFFFAOYSA-N
InChIInChI=1S/C10H16O2/c1-7(2)9-5-4-8(3)10(11)12-6-9/h8-9H,1,4-6H2,2-3H3
SMILESC=C(C)C1CCC(C)C(=O)OC1
MNX internals
InChI (mnx)InChI=1/C10H16O2/c1-7(2)9-5-4-8(3)10(11)12-6-9/h8-9H,1,4-6H2,2-3H3/t8?,9? Image of MNXM1107533
SMILES (mnx)[CH2:1]=[C:7]([CH3:2])[CH:9]1[CH2:5][CH2:4][CH:8]([CH3:3])[C:10](=[O:11])[O:12][CH2:6]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:64229
chebi:64229
BBKYOZJVRPOMGL-UHFFFAOYSA-N 		6-isopropenyl-3-methyloxepan-2-one
3-methyl-6-(prop-1-en-2-yl)oxepan-2-one
3-methyl-6-isopropenyloxepan-2-one

seed.compound:cpd22198
seedM:cpd22198
BBKYOZJVRPOMGL-UHFFFAOYSA-N 		6-isopropenyl-3-methyloxepan-2-one

metacyc.compound:6-isopropenyl-3-methyloxepan-2-one
metacycM:6-isopropenyl-3-methyloxepan-2-one
BBKYOZJVRPOMGL-UHFFFAOYSA-N 		a 6-isopropenyl-3-methyloxepan-2-one
a 6-isopropenyl-3-methyl-2oxo-oxepanon
an isoprop(en)ylmethyloxepan-2-one

seedM:M_cpd22198 		secondary/obsolete/fantasy identifier