GOLM METABOLOME DATABASE
How would you rate the quality of this mass spectrum?
poor, not helpful 
 outstanding, most helpful.
This spectrum was 0 times rated; on average=0.0

Biotin (3TMS)

 

Replica Mass Spectra of Biotin (3TMS)

replicalib entry datedetectionmethodspecies
428 August 2012  MassBank GC 2010 Tsujimoto 
330 March 2011  Fiehn_GC_2010 
219 July 2007 MS-TOFVAR5Reference Substance
3 spectrum(a)
rotate: click+drag; translate: alt+click+drag; zoom: mousewheel; save: mol

Spectrum Details

analyteBiotin (3TMS)
analyte InChIInChI=1S/C19H40N2O3SSi3/c1-26(2,3)20-15-14-25-16(18(15)21(19(20)23)27(4,5)6)12-10-11-13-17(22)24-28(7,8)9/h15-16,18H,10-14H2,1-9H3/t15-,16-,18-/m0/s1
analyte mass460.86
chromatogram6069hf_19
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 role 
retention time (sec)869.51
retention index (VAR5 method, n-alkanes C10–C36) 
base peak (m/z)73
maximal intensity556.436
mass-intensity-peaks cardinality454 intensities
minimal m/z45
maximal m/z1.000
download JCAMP DXSpectrumJcampDx.ashx?id=47d94ab4-343a-481f-8cd6-b5a7c333b617
download MSPSpectrumMsp.ashx?id=47d94ab4-343a-481f-8cd6-b5a7c333b617

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

comments on this mass spectrum

Post a Comment
Name:
 
Website:  
Email:
Comments:
service last updated 17/07/2014 © 2008-2014 Golm Metabolome Database - All rights reserved
Top