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1-isocyanatomethyl-1,3,3-trimethylcyclohexane

PropertiesImage
MNX_IDMNXM32827 Image of MNXM32827
referencechebi:59136
formulaC11H19NO
global charge0
mol weight181.279
InChIKeyTZBAIMGBDFXZMO-UHFFFAOYSA-N
InChIInChI=1S/C11H19NO/c1-10(2)5-4-6-11(3,7-10)8-12-9-13/h4-8H2,1-3H3
SMILESCC1(C)CCCC(C)(CN=C=O)C1
MNX internals
InChI (mnx)InChI=1/C11H19NO/c1-10(2)5-4-6-11(3,7-10)8-12-9-13/h4-8H2,1-3H3/t11? Image of MNXM32827
SMILES (mnx)[CH3:1][C:10]1([CH3:2])[CH2:5][CH2:4][CH2:6][C:11]([CH3:3])([CH2:8][N:12]=[C:9]=[O:13])[CH2:7]1
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:59136
chebi:59136
TZBAIMGBDFXZMO-UHFFFAOYSA-N
1-isocyanatomethyl-1,3,3-trimethylcyclohexane
1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane