Feedback

1,6,6-trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one

Properties

Image

Occurences in reactions

MNX_ID

MNXM2762

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

formula

C₁₀H₁₆O₃

charge

mass

184.10994

reference

InChIKey

KAUZXNDCPVMFCH-UHFFFAOYSA-N

InChI

InChI=1S/C10H16O3/c1-9(2)7-4-5-10(3,13-9)12-8(11)6-7/h7H,4-6H2,1-3H3

SMILES

CC12CCC(CC(=O)O1)C(C)(C)O2

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:29064 chebi:29064	1,6,6-trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one 1,6,6-Trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one 1,6,6-trimethyl-2,7-dioxabicyclo-[3.2.2]nonan-3-one
kegg.compound:C04718 keggC:C04718	1,6,6-Trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one
seed.compound:cpd02874 seedM:cpd02874	1,6,6-Trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one 1,6,6-trimethyl-2,7-dioxabicyclo(3,2,2)nonan-3-one 1,6,6-trimethyl-2,7-dioxobicyclo-(3,2,2)nonan-3-one
metacyc.compound:CPD-788 metacycM:CPD-788	1,6,6-trimethyl-2,7-dioxobicyclo-(3,2,2)nonan-3-one 1,6,6-trimethyl-2,7-dioxabicyclo(3,2,2)nonan-3-one
chebi:11177 chebi:18947 chebi:552 keggC:M_C04718 seedM:M_cpd02874	secondary/obsolete/fantasy identifier