GOLM METABOLOME DATABASE

- home
- search
- ms analysis
  - library search
  - prediction
- GoBioSpace
- blog
- thanks to
- publications
- imprint
- privacy policy
- contact
- help

The GMD web site use latest HTML5 features! This message indicates backward compatibility problems in GMD's mass spectra, chemical compound structure and metabolite profile visualizations. As your browser does not support the HTML5 <canvas> element, please consider to upgrade to a HTML5 ready web browser, including Microsoft Internet Explorer, Mozilla Firefox, Apple Safari, Google Chrome and Opera, to fully enjoy GMD's functionalities!

Details Ethyl hexanoate

rotate: click+drag; translate: alt+click+drag; zoom: mousewheel; save: mol

Role	Reference Substance
name	Ethyl hexanoate
MPIMP ID	R002977
stereoisomer
isotopomer	ambient
formula	C8 H16 O2
molecular mass	144.212
monoisotopic mass	144.11503
InChI	InChI=1S/C8H16O2/c1-3-5-6-7-8(9)10-4-2/h3-7H2,1-2H3
InChIKey	SHZIWNPUGXLXDT-UHFFFAOYSA-N
supplier	Aldrich
supplier code	148962
lot	S28172-129
purity	99
solubility
general
amount	5
amount unit	ML
store temperature 1	RT
store temperature 2
store dry
store under argon
store in dark
contributing author	Fehrle I, Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
date of order
date in	2009-06-04
date out
date expired
box number	362
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/ReferenceSubstance(guid%27bf488053-7122-4c66-8361-7cc44d0729ad%27)

Synonyms of Ethyl hexanoate

property	value
CAS	123-66-0
ChemSpider ID	29005
MetaCyc	CPD-10093
synonym	Caproic acid ethyl ester
synonym	Ethyl caproate
synonym	Ethyl hexanoate
synonym	Hexanoic acid ethyl ester
7 synonym(s)

Metabolites mapped to Ethyl hexanoate

metabolite	stereoisomer	isotopomer
no hits!

Replica of Ethyl hexanoate

reference substance	supplier	supplier code	lot
No Reference substances found!

compound timestamp information
deposited	at 6/4/2009 by Fehrle I., Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
last changed	at 8/7/2013 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Fehrle I., Hummel J.

Show all reference substances

Top