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Sucrose (8TMS)

 

Replica Mass Spectra of Sucrose (8TMS)

replicalib entry datedetectionmethodspecies
122 February 2005 MS-TOFM[STR] 
4028 August 2012  MassBank GC 2010 Kusano 
212 October 2005 MS-TRAPM[BAR] 
425 January 2005 MS-TOFM[MOR] 
505 October 2004 MS-QuadM[2]Standard
3617 March 2010 MS-TOFVAR5Brassica oleracea
626 November 2004  M[FAME4090]Standard
715 March 2005 MS-TOFM[6]Reference Substance
3803 November 2010  Schomburg_GC_2010 
819 July 2007 MS-TOFVAR5Reference Substance
34 spectrum(a)
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Spectrum Details

analyteSucrose (8TMS)
analyte InChIInChI=1S/C36H86O11Si8/c1-48(2,3)37-25-28-30(43-51(10,11)12)32(45-53(16,17)18)33(46-54(19,20)21)35(40-28)42-36(27-39-50(7,8)9)34(47-55(22,23)24)31(44-52(13,14)15)29(41-36)26-38-49(4,5)6/h28-35H,25-27H2,1-24H3/t28-,29-,30-,31-,32+,33-,34+,35-,36+/m1/s1
analyte mass919.75
chromatogram6037hf_64
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)823.19
retention index (VAR5 method, n-alkanes C10–C36) 
base peak (m/z)73
maximal intensity1.351.824
mass-intensity-peaks cardinality543 intensities
minimal m/z45
maximal m/z996
download JCAMP DXSpectrumJcampDx.ashx?id=ecd5ba9f-0d33-4f10-b933-403fc180d465
download MSPSpectrumMsp.ashx?id=ecd5ba9f-0d33-4f10-b933-403fc180d465

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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