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Ribulose-5-phosphate (1MEOX) (5TMS) BP

 

Replica Mass Spectra of Ribulose-5-phosphate (1MEOX) (5TMS) BP

replicalib entry datedetectionmethodspecies
119 July 2007 MS-TOFVAR5Reference Substance
1028 August 2012  MassBank GC 2010 Tsujimoto 
222 February 2005 MS-TOFM[STR] 
803 November 2010  Schomburg_GC_2010 
930 March 2011  Fiehn_GC_2010 
326 November 2004  M[FAME4090]Standard
422 February 2005 MS-TOFM[STR] 
612 May 2005  M[NIST] 
8 spectrum(a)
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Spectrum Details

analyteRibulose-5-phosphate (1MEOX) (5TMS) BP
analyte InChIInChI=1S/C21H54NO8PSi5/c1-24-22-19(17-26-32(2,3)4)21(28-34(8,9)10)20(27-33(5,6)7)18-25-31(23,29-35(11,12)13)30-36(14,15)16/h20-21H,17-18H2,1-16H3/b22-19-/t20-,21+/m1/s1
analyte mass620.06
chromatogram6075hf_44
citation 
authorsBoelling C, Liebig F, Erban A, 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 date19 July 2007
metabolite roleMETB
retention time (sec)687.94
retention index (VAR5 method, n-alkanes C10–C36) 
base peak (m/z)73
maximal intensity639,181
mass-intensity-peaks cardinality496 intensities
minimal m/z45
maximal m/z997
download JCAMP DXSpectrumJcampDx.ashx?id=fc67a419-f9bb-46a8-97f8-ef9baa8a3029
download MSPSpectrumMsp.ashx?id=fc67a419-f9bb-46a8-97f8-ef9baa8a3029

GC-Method

nameMDN35
citationKopka J, Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
attributetextdetails
deconvolutionChromaTOFBASELINE OFFSET: 1; SMOOTHING: 5; PEAK WIDTH: 3s; S/N: 10
derivatizationMEOX; MSTFAMETHOXYAMINATION: 120min at 37°C; TRIMETHYLSILYLATION: 30min at 37°C
detectorMS-TOFm/z = 70-600; scans:20/s;
extractionchloroform:dH2O (2:1; v/v); chloroform (20°C); dH2O (4°C)
ion sourceEI70eV
RIFAME, d6-CholesteroleFAME: C8, C9, C10, C12, C14, C16, C18, C20, C22, C24, C26, C28, C30
separationGCCOLUMN:35%phenyl-65%dimethylpolysiloxane, 30m, ID:0.32mm, DF:0.25µm, MDN-35 (Macherey-Nagel, Düren, Germany); PROGRAM:iso 2min 80°C, ramp 15°C/min, iso 6min 330°C; FLOW:Helium, 2mL/min; INJECTION:1µL, splitless, 230°C; TRANSFER:250°C; IONSOURCE:250°C

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