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Malonic acid (3TMS)

 

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Replica Mass Spectra of Malonic acid (3TMS)

replica	lib entry date	detection	method	species
4	30 March 2011		Fiehn_GC_2010
2	12 May 2005		M[NIST]
3	19 July 2007	MS-TOF	VAR5	Reference Substance
3 spectrum(a)

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Spectrum Details

analyte	Malonic acid (3TMS)
analyte InChI	InChI=1S/C12H28O4Si3/c1-17(2,3)14-11(13)10-12(15-18(4,5)6)16-19(7,8)9/h10H,1-9H3
analyte mass	320.61
chromatogram	4086ED52
citation
authors	Fiehn O, Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
lib entry date	26 November 2004
metabolite role	MST
retention time (sec)
retention index (VAR5 method, n-alkanes C10–C36)	1,391.68 (predicted, according to Strehmel, N. et.al)
base peak (m/z)	147
maximal intensity	999
mass-intensity-peaks cardinality	88 intensities
minimal m/z	85
maximal m/z	321
download JCAMP DX	SpectrumJcampDx.ashx?id=054f4f20-823a-4df0-bb66-a8c3d9956008
download MSP	SpectrumMsp.ashx?id=054f4f20-823a-4df0-bb66-a8c3d9956008

GC-Method

name	M[FAME4090]
citation

attribute	text	details
ion source	EI

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