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Noradrenaline (5TMS)

 

Replica Mass Spectra of Noradrenaline (5TMS)

replicalib entry datedetectionmethodspecies
101 February 2005 MS-TOFM[6]Reference Substance
201 May 2001 MS-TOFM[EIGTMS]Standard
1030 March 2011  Fiehn_GC_2010 
325 January 2005 MS-TOFM[MOR] 
419 July 2007 MS-TOFVAR5Reference Substance
1105 June 2013  MRI_2013 
501 September 2001 MS-QuadM[2]Solanum tuberosum
612 May 2005  M[NIST] 
701 September 2001 MS-QuadM[2]Standard Addition
807 September 2004 MS-QuadM[2]Standard
10 spectrum(a)
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Spectrum Details

analyteNoradrenaline (5TMS)
analyte InChIInChI=1S/C23H51NO3Si5/c1-28(2,3)24(29(4,5)6)19-23(27-32(13,14)15)20-16-17-21(25-30(7,8)9)22(18-20)26-31(10,11)12/h16-18,23H,19H2,1-15H3/t23-/m0/s1
analyte mass530.08
chromatogram6066hf_28
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)689.53
retention index (VAR5 method, n-alkanes C10–C36) 
base peak (m/z)73
maximal intensity907,620
mass-intensity-peaks cardinality430 intensities
minimal m/z70
maximal m/z588
download JCAMP DXSpectrumJcampDx.ashx?id=b26abb69-7f9c-4313-87d8-ffb94b1ba856
download MSPSpectrumMsp.ashx?id=b26abb69-7f9c-4313-87d8-ffb94b1ba856

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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