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Details

Stereochemistry RACEMIC
Molecular Formula C10H20O2
Molecular Weight 172.2646
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Methylpentyl butyrate

SMILES

CCCC(=O)OCCC(C)CC

InChI

InChIKey=GZWUADMYQBNKGP-UHFFFAOYSA-N
InChI=1S/C10H20O2/c1-4-6-10(11)12-8-7-9(3)5-2/h9H,4-8H2,1-3H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
3-Methylpentyl butyrate
Systematic Name English
3-Methylpentyl butanoate
Systematic Name English
Butanoic acid, 3-methylpentyl ester
Systematic Name English
Code System Code Type Description
CAS
84254-83-1
Created by admin on Sat Dec 16 19:07:13 GMT 2023 , Edited by admin on Sat Dec 16 19:07:13 GMT 2023
PRIMARY
PUBCHEM
3019776
Created by admin on Sat Dec 16 19:07:13 GMT 2023 , Edited by admin on Sat Dec 16 19:07:13 GMT 2023
PRIMARY
EPA CompTox
DTXSID501004511
Created by admin on Sat Dec 16 19:07:13 GMT 2023 , Edited by admin on Sat Dec 16 19:07:13 GMT 2023
PRIMARY
FDA UNII
WVY3Z4DBK3
Created by admin on Sat Dec 16 19:07:13 GMT 2023 , Edited by admin on Sat Dec 16 19:07:13 GMT 2023
PRIMARY
NIH
NCATS
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