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Xylulose (1MEOX) (4TMS) MP

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Replica Mass Spectra of Xylulose (1MEOX) (4TMS) MP

replica	lib entry date	detection	method	species
10	23 July 2012	MS-TOF	VAR5
8	10 December 2010	MS-TOF	VAR5
1	22 February 2005	MS-TOF	M[STR]
2	25 January 2005	MS-TOF	M[MOR]
9	03 November 2010		Schomburg_GC_2010
3	19 July 2007	MS-TOF	VAR5	Reference Substance
12	28 August 2012		MassBank GC 2010 Kusano
4	19 July 2007	MS-TOF	MDN35	Reference Substance
15	28 August 2012		MassBank GC 2010 Ara
16	28 August 2012		MassBank GC 2010 Ara
11 spectrum(a)
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Spectrum Details

analyte	Xylulose (1MEOX) (4TMS) MP
analyte InChI	InChI=1S/C18H45NO5Si4/c1-20-19-16(14-21-25(2,3)4)18(24-28(11,12)13)17(23-27(8,9)10)15-22-26(5,6)7/h17-18H,14-15H2,1-13H3/b19-16+/t17-,18-/m1/s1
analyte mass	467.9
chromatogram	NA(_46)
citation	Strelkov S, von Elstermann M, Schomburg D (2004) Biological Chemistry 385, 853-861
authors	Strelkov S, University of Cologne, CUBIC - Institute of Biochemistry, Department Prof. Schomburg, Zuelpicher Str. 47, D-50674 Cologne, Germany
lib entry date	22 February 2005
metabolite role	MST
retention time (sec)
retention index (VAR5 method, n-alkanes C10–C36)	1,665.24 (predicted, according to Strehmel, N. et.al)
base peak (m/z)	73
maximal intensity	999
mass-intensity-peaks cardinality	160 intensities
minimal m/z	45
maximal m/z	467
download JCAMP DX	SpectrumJcampDx.ashx?id=34818d7d-0461-4250-9eb5-ecd789446d06
download MSP	SpectrumMsp.ashx?id=34818d7d-0461-4250-9eb5-ecd789446d06

GC-Method

name	M[STR]
citation	Strelkov S, von Elstermann M, Schomburg D (2004) Biological Chemistry 385, 853-861

attribute	text	details
detector	MS-TOF
ion source	EI	70eV
RI	ALKANE	C10, C12, C15, C19, C22, C28, C32, C36
separation	GC	DB-5MS column (30m x 0.25µm) from J&W Scientific (Folsom, USA)

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