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Adenosine (3TMS) (Derivate not found)

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Replica Mass Spectra of Adenosine (3TMS) (Derivate not found)

replica	lib entry date	detection	method	species
4	03 November 2010		Schomburg_GC_2010
2	29 November 2003	MS-Quad	M[2]	Standard
3	01 August 2002	MS-Quad	M[2]	Lotus japonicus (Regel) K. Larsen
3 spectrum(a)

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Spectrum Details

analyte	Adenosine (3TMS) (Derivate not found)
analyte InChI
analyte mass	483.79
chromatogram	3223BF23
citation	Schauer N, Steinhauser D, Strelkov S, Schomburg D, Allison G, Moritz T, Lundgren K, Roessner-Tunali U, Forbes MG, Willmitzer L, Fernie AR, Kopka J (2005) FEBS Letters 579, 1332-1337
authors	Kopka J, Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
lib entry date	15 December 2003
metabolite role	METB
retention time (sec)	2,292.96
retention index (VAR5 method, n-alkanes C10–C36)	2,612.19 (predicted, according to Strehmel, N. et.al)
base peak (m/z)	73
maximal intensity	999
mass-intensity-peaks cardinality	171 intensities
minimal m/z	41
maximal m/z	483
download JCAMP DX	SpectrumJcampDx.ashx?id=2d390070-06c8-43aa-a5e4-a38cbd700c1f
download MSP	SpectrumMsp.ashx?id=2d390070-06c8-43aa-a5e4-a38cbd700c1f

GC-Method

name	M[2]
citation	Roessner U, Wagner C, Kopka J, Trethewey RN, Willmitzer L (2000) Plant J 23, 131-142

attribute	text	details
deconvolution	AMDIS, National Institute of Standards and Technology, Gaithersburg, MD, USA	DIRECTION:Low to High; WIDTH: 20; SUBTRACTION: two; RESOLUTION: low; SENSITIVITY: low; SHAPE: low
derivatization	MEOX; TMS	Methoxyamination:60min37°C; Trimethylsilylation:>45min37°C
detector	MS-Quad	m/z = 35-600; scans:2/s; MD 800 Thermo-Finnigan, San Jose, CA, USA
extraction	methanol:water (4:1; v/v); 15min70°C
ion source	EI	70eV
metabolic inactivation	cut; liquid nitrogen; -80°C
partitioning	methanol fraction of a methanol:water:chloroform (approx. 2:2:1, v/v/v) partitioning
RI	ALKANE	C12, C15, C19, C22, C28, C32, C36
separation	GC	COLUMN:5%diphenyl-95%dimethylpolysiloxane (arylene), 30+10m, ID:0.25mm, DF:0.25microm, Rtx-5SilMS Integra-Guard, #NA (Restek, Bad Homburg, Germany); PROGRAM:iso1min70°C, ramp9°C/min, iso5min350°C; FLOW:Helium, 0.6ml/min; INJECTION:1microL, splitless, 230°C; TRANSFER:250°C; IONSOURCE:250°C

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