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Details of Alanylalanine (1TMS)

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Role	Analyte
name	Alanylalanine (1TMS)
MPIMP ID	A148012
isotopomer	ambient
formula	C9H20N2O3Si
molecular mass	232.353
monoisotopic mass	232.12432
InChI	InChI=1S/C9H20N2O3Si/c1-6(10)8(12)11-7(2)9(13)14-15(3,4)5/h6-7H,10H2,1-5H3,(H,11,12)
InChIKey	MOWDDBSBJDXWGU-UHFFFAOYSA-N
substructure TMS	1
substructure TBS	0
substructure H3ON	0
substructure CH3O	0
retention index (VAR5 method, n-alkanes C10–C36)	1,489.46
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%276010d04d-b018-4e76-b8cf-242790766d93%27)

Synonyms of Alanylalanine (1TMS)

property	value
synonym	Alanylalanine (1TMS)
synonym	B000081
2 synonym(s)

Metabolite mapped to Alanylalanine (1TMS)

metabolite	stereoisomer	isotopomer
Alanylalanine	L-, L-	ambient
1 metabolite(s)

Reference spectra of Alanylalanine (1TMS)

replica	entry date	detection	method	species
1	7/19/2007 11:16:30 AM		VAR5	Reference Substance
1 spectrum(a)

compound timestamp information
deposited	at 7/16/2007 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed	at 10/1/2012 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.

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