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Cinnamic acid, 2-hydroxy-, trans- (2TMS)

 

Replica Mass Spectra of Cinnamic acid, 2-hydroxy-, trans- (2TMS)

replicalib entry datedetectionmethodspecies
212 May 2005  M[NIST] 
1530 March 2011  Fiehn_GC_2010 
301 November 2001 MS-QuadM[2]Standard
412 May 2005  M[NIST] 
501 January 2002 MS-TOFM[EIGTMS]Standard
1628 August 2012  MassBank GC 2010 Kusano 
626 November 2004  M[FAME4090]Standard
1805 June 2013  MRI_2013 
701 February 2005 MS-TOFM[6]Reference Substance
812 May 2005  M[NIST] 
17 spectrum(a)
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Spectrum Details

analyteCinnamic acid, 2-hydroxy-, trans- (2TMS)
analyte InChIInChI=1S/C15H24O3Si2/c1-19(2,3)17-14-10-8-7-9-13(14)11-12-15(16)18-20(4,5)6/h7-12H,1-6H3/b12-11+
analyte mass308.52
chromatogram6051hf_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)617.89
retention index (VAR5 method, n-alkanes C10–C36) 
base peak (m/z)147
maximal intensity812,028
mass-intensity-peaks cardinality706 intensities
minimal m/z45
maximal m/z1,000
download JCAMP DXSpectrumJcampDx.ashx?id=e636c1dd-50f5-45e6-bd43-01c3e3af4cfb
download MSPSpectrumMsp.ashx?id=e636c1dd-50f5-45e6-bd43-01c3e3af4cfb

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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