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Mandelic acid, 4-hydroxy-3-methoxy- (3TMS)

 

Replica Mass Spectra of Mandelic acid, 4-hydroxy-3-methoxy- (3TMS)

replicalib entry datedetectionmethodspecies
428 August 2012  MassBank GC 2010 Tsujimoto 
119 July 2007 MS-TOFVAR5Reference Substance
219 July 2007 MS-TOFMDN35Reference Substance
330 March 2011  Fiehn_GC_2010 
4 spectrum(a)
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Spectrum Details

analyteMandelic acid, 4-hydroxy-3-methoxy- (3TMS)
analyte InChIInChI=1S/C18H34O5Si3/c1-20-16-13-14(11-12-15(16)21-24(2,3)4)17(22-25(5,6)7)18(19)23-26(8,9)10/h11-13,17H,1-10H3
analyte mass414.72
chromatogram10300xx_41
citationNA
authorsKopka 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 date05 June 2013
metabolite role 
retention time (sec) 
retention index (VAR5 method, n-alkanes C10–C36)1.873,05 (predicted, according to Strehmel, N. et.al)
base peak (m/z)297
maximal intensity2.893.857
mass-intensity-peaks cardinality349 intensities
minimal m/z60
maximal m/z545
download JCAMP DXSpectrumJcampDx.ashx?id=a346d74a-7ede-4793-8ad1-ca2c9ddddf06
download MSPSpectrumMsp.ashx?id=a346d74a-7ede-4793-8ad1-ca2c9ddddf06

GC-Method

nameMRI_2013
citation 
no method details available

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