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1-Methylbutyl butanoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM115994

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

formula

C₉H₁₈O₂

charge

mass

158.13068

reference

InChIKey

DJOCFLQKCMWABC-UHFFFAOYSA-N

InChI

InChI=1S/C9H18O2/c1-4-6-8(3)11-9(10)7-5-2/h8H,4-7H2,1-3H3

SMILES

CCCC(=O)OC(C)CCC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
lipidmaps:LMFA07010712 lipidmapsM:LMFA07010712	1-Methylbutyl butanoate WE 9:0 pentan-2-yl butanoate
hmdb:HMDB0039219	1-Methylbutyl butanoate 1-Methylbutyl butanoic acid 1-Methylbutyl butyrate 2-Pentyl butanoate 2-Pentyl butyrate Butanoic acid, 1-methylbutyl ester Butanoic acid, 2-pentyl ester Butyric acid, sec-pentyl ester FEMA 3893 Sec-amyl butyrate pentan-2-yl butanoate
hmdb:HMDB39219	secondary/obsolete/fantasy identifier