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Alanine (3TMS)

 

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Replica Mass Spectra of Alanine (3TMS)

replica	lib entry date	detection	method	species
1	11 September 2005		M[FAME4090]	Standard
2	01 August 2002	MS-Quad	M[2]	Lotus japonicus (Regel) K. Larsen
3	12 June 2003	MS-Quad	M[2]	Arabidopsis thaliana
4	15 March 2005	MS-TOF	M[6]	Reference Substance
5	01 October 2001	MS-TOF	M[EIGTMS]	Standard Addition
7	01 August 2002	MS-Quad	M[2]	Lotus japonicus (Regel) K. Larsen
9	22 February 2005	MS-TOF	M[STR]
19	03 November 2010		Schomburg_GC_2010
11	01 August 2002	MS-Quad	M[2]	Lotus japonicus (Regel) K. Larsen
12	01 November 2001	MS-TOF	M[EIGTMS]	Corynebacterium glutamicum
14 spectrum(a)
Page of 2     Results per page: 5 10 25 50 100 500

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Spectrum Details

analyte	Alanine (3TMS)
analyte InChI	InChI=1S/C12H31NO2Si3/c1-11(12(14)15-18(8,9)10)13(16(2,3)4)17(5,6)7/h11H,1-10H3
analyte mass	305.64
chromatogram	NA(_49)
citation
authors	Roessner-Tunali U, Forbes MG, University of Melbourne, School of Botany, 3010 Victoria, Australia
lib entry date	19 January 2005
metabolite role	METB
retention time (sec)
retention index (VAR5 method, n-alkanes C10–C36)	1,360.5 (predicted, according to Strehmel, N. et.al)
base peak (m/z)	188
maximal intensity	999
mass-intensity-peaks cardinality	111 intensities
minimal m/z	72
maximal m/z	476
download JCAMP DX	SpectrumJcampDx.ashx?id=30879af1-ead2-4f67-ae8f-4bd3aa9976a7
download MSP	SpectrumMsp.ashx?id=30879af1-ead2-4f67-ae8f-4bd3aa9976a7

GC-Method

name	M[ROE]
citation	U. Roessner, J. Patterson, M. Forbes, G. Fincher, P. Langridge, A. Bacic, Plant Physiology 142 (2006) 1087

attribute	text	details
deconvolution	Xcalibur program
derivatization	MEOX; MSTFA	METHOXYAMINATION: 120min at 37°C; SILYLATION: 30min at 37°C
detector	MS-QUAD	m/z = 70-600; scans:2/s; DSQ quadrupole mass spectrometer
extraction	methanol:chloroform
ion source	EI	70eV
RI	ALKANE	C12, C15, C19, C22, C28, C32, C36
separation	GC	COLUMN:5%diphenyl-95%dimethylpolysiloxane, 30+10m, ID:0.25mm, DF:0.25µm, VF-5MS (Varian, Darmstadt, Germany); PROGRAM:injection at 70°C, ramp 1°C/min to 76°C, ramp 6°C/min to 330°C, iso at 330°C for 10min; FLOW:Helium, 1mL/min; INJECTION:1µL, splitless, 230°C; TRANSFER:280°C; IONSOURCE:250°C

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