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3,5,5-Trimethylhexanal

PropertiesImage
MNX_IDMNXM117248 Image of MNXM117248
referencechebi:179602
formulaC9H18O
global charge0
mol weight142.242
InChIKeyWTPYRCJDOZVZON-UHFFFAOYSA-N
InChIInChI=1S/C9H18O/c1-8(5-6-10)7-9(2,3)4/h6,8H,5,7H2,1-4H3
SMILESCC(CC=O)CC(C)(C)C
MNX internals
InChI (mnx)InChI=1/C9H18O/c1-8(5-6-10)7-9(2,3)4/h6,8H,5,7H2,1-4H3/t8? Image of MNXM117248
SMILES (mnx)[CH3:1][CH:8]([CH2:5][CH:6]=[O:10])[CH2:7][C:9]([CH3:2])([CH3:3])[CH3:4]
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:179602
chebi:179602
WTPYRCJDOZVZON-UHFFFAOYSA-N 		3,5,5-Trimethylhexanal
3,5,5-trimethylhexanal
hmdb:HMDB0031730
WTPYRCJDOZVZON-UHFFFAOYSA-N 		3,5,5-Trimethylhexanal
3,5,5-Trimethl-hexanal
3,5,5-Trimethyl N-hexanal
3,5,5-Trimethyl-hexanal
3,5,5-Trimethylcapronaldehyde
3,5,5-trimethylhexanal
FEMA 3524
Isononylaldehyde
Isonylaldehyde
Tert-butylisopentanal
hexanal, 3,5,5-trimethyl-

hmdb:HMDB31730 		secondary/obsolete/fantasy identifier