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Isocitric acid (4TMS)

 

Replica Mass Spectra of Isocitric acid (4TMS)

replicalib entry datedetectionmethodspecies
2528 August 2012  MassBank GC 2010 Kusano 
111 September 2005  M[FAME4090]Standard
219 January 2005 MS-QUADM[ROE] 
2728 August 2012  MassBank GC 2010 Ara 
319 July 2007 MS-TOFMDN35Reference Substance
2628 August 2012  MassBank GC 2010 Tsujimoto 
601 October 2001 MS-TOFM[EIGTMS]Standard
812 May 2005  M[NIST] 
922 February 2005 MS-TOFM[STR] 
1012 October 2005 MS-TRAPM[BAR] 
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Spectrum Details

analyteIsocitric acid (4TMS)
analyte InChIInChI=1S/C18H40O7Si4/c1-26(2,3)22-15(19)13-14(17(20)24-28(7,8)9)16(23-27(4,5)6)18(21)25-29(10,11)12/h14,16H,13H2,1-12H3
analyte mass480.85
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)1,826.3 (predicted, according to Strehmel, N. et.al)
base peak (m/z)73
maximal intensity1,254,835
mass-intensity-peaks cardinality375 intensities
minimal m/z60
maximal m/z550
download JCAMP DXSpectrumJcampDx.ashx?id=a3135d64-9ddb-4fae-86a4-61c9e451108d
download MSPSpectrumMsp.ashx?id=a3135d64-9ddb-4fae-86a4-61c9e451108d

GC-Method

nameMRI_2013
citation 
no method details available

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