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2-Hexenyl octanoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM116751

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

formula

C₁₄H₂₆O₂

charge

mass

226.19328

reference

InChIKey

IRUGSDVUJNNIMW-DHZHZOJOSA-N

InChI

InChI=1S/C14H26O2/c1-3-5-7-9-10-12-14(15)16-13-11-8-6-4-2/h8,11H,3-7,9-10,12-13H2,1-2H3/b11-8+

SMILES

CCC/C=C/COC(=O)CCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:171864 chebi:171864	2-Hexenyl octanoate [(E)-hex-2-enyl] octanoate
hmdb:HMDB0032321	2-Hexenyl octanoate (2E)-2-Hexenyl octanoate (2E)-hex-2-en-1-yl octanoate (e)-2-Hexenyl octanoate 2-Hexenyl ester(e)-octanoic acid 2-Hexenyl octanoic acid trans-2-Hexenyl N-octanoate
lipidmaps:LMFA07010718 lipidmapsM:LMFA07010718	2-Hexenyl octanoate (2E)-hex-2-en-1-yl octanoate WE 14:1
hmdb:HMDB32321	secondary/obsolete/fantasy identifier