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 of Pseudoephedrine glycinamide (3TMS)

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

Role	Analyte
name	Pseudoephedrine glycinamide (3TMS)
MPIMP ID	A221017
isotopomer	ambient
formula
molecular mass
monoisotopic mass
InChI	InChI=1S/C21H42N2O2Si3/c1-18(21(25-28(9,10)11)19-15-13-12-14-16-19)22(2)20(24)17-23(26(3,4)5)27(6,7)8/h12-16,18,21H,17H2,1-11H3/t18-,21+/m0/s1
InChIKey	ISOXYIVDAHPEGZ-GHTZIAJQSA-N
substructure TMS
substructure TBS
substructure H3ON
substructure CH3O
retention index (VAR5 method, n-alkanes C10–C36)	2,210.52
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%2701c4e9eb-0de8-4564-803b-1f71582ddd49%27)

Synonyms of Pseudoephedrine glycinamide (3TMS)

property	value
synonym	Pseudoephedrine glycinamide (3TMS)
1 synonym(s)

Metabolite mapped to Pseudoephedrine glycinamide (3TMS)

metabolite	stereoisomer	isotopomer
2-Amino-N-((1S,2S)-(2-hydroxy-1-methyl-2-phenyl) ethyl)-N-methylacetamide	(+)-	ambient
1 metabolite(s)

Reference spectra of Pseudoephedrine glycinamide (3TMS)

replica	entry date	method
2	4/6/2011 7:28:46 PM	VAR5
1	4/6/2011 7:04:34 PM	VAR5
2 spectrum(a)

compound timestamp information
deposited	at 4/6/2011 by Kopka J., 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 12/12/2011 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Kopka J., Hummel J.

Show all analytes

Top