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Aspartic acid (2TMS)

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Replica Mass Spectra of Aspartic acid (2TMS)

replica	lib entry date	detection	method	species
2	22 February 2005	MS-TOF	M[STR]
13	03 November 2010		Schomburg_GC_2010
12	03 December 2009	MS-TOF	VAR5	Arabidopsis thaliana
6	01 September 2001	MS-TOF	M[EIGTMS]	Saccharomyces cerevisiae
8	19 July 2007	MS-TOF	VAR5	Reference Substance
9	01 November 2001	MS-TOF	M[EIGTMS]	Corynebacterium glutamicum
10	19 July 2007	MS-TOF	VAR5	Reference Substance
11	01 May 2001	MS-TOF	M[EIGTMS]	Arabidopsis thaliana
14	30 March 2011		Fiehn_GC_2010
9 spectrum(a)

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Spectrum Details

analyte	Aspartic acid (2TMS)
analyte InChI	InChI=1S/C10H23NO4Si2/c1-16(2,3)14-9(12)7-8(11)10(13)15-17(4,5)6/h8H,7,11H2,1-6H3/t8-/m1/s1
analyte mass	277.47
chromatogram	NA(_46)
citation	Strelkov S, von Elstermann M, Schomburg D (2004) Biological Chemistry 385, 853-861
authors	Strelkov S, University of Cologne, CUBIC - Institute of Biochemistry, Department Prof. Schomburg, Zuelpicher Str. 47, D-50674 Cologne, Germany
lib entry date	22 February 2005
metabolite role	METB
retention time (sec)
retention index (VAR5 method, n-alkanes C10–C36)	1,420.92 (predicted, according to Strehmel, N. et.al)
base peak (m/z)	73
maximal intensity	999
mass-intensity-peaks cardinality	109 intensities
minimal m/z	41
maximal m/z	277
download JCAMP DX	SpectrumJcampDx.ashx?id=95a2886b-a602-4968-a6d0-be9f5f46e3e2
download MSP	SpectrumMsp.ashx?id=95a2886b-a602-4968-a6d0-be9f5f46e3e2

GC-Method

name	M[STR]
citation	Strelkov S, von Elstermann M, Schomburg D (2004) Biological Chemistry 385, 853-861

attribute	text	details
detector	MS-TOF
ion source	EI	70eV
RI	ALKANE	C10, C12, C15, C19, C22, C28, C32, C36
separation	GC	DB-5MS column (30m x 0.25µm) from J&W Scientific (Folsom, USA)

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