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Glucose-6-phosphate (1MEOX) (6TMS) BP

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Replica Mass Spectra of Glucose-6-phosphate (1MEOX) (6TMS) BP

replica	lib entry date	detection	method	species
18	28 August 2012		MassBank GC 2010 Kusano
1	22 February 2005	MS-TOF	M[STR]
2	19 January 2005	MS-QUAD	M[ROE]
3	19 July 2007	MS-TOF	VAR5	Reference Substance
4	19 July 2007	MS-TOF	VAR5	Reference Substance
6	01 November 2001	MS-Quad	M[2]	Standard
20	05 June 2013		MRI_2013
7	01 August 2002	MS-Quad	M[2]	Lotus japonicus (Regel) K. Larsen
19	28 August 2012		MassBank GC 2010 Ara
8	12 June 2003	MS-Quad	M[2]	Arabidopsis thaliana
19 spectrum(a)
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Spectrum Details

analyte	Glucose-6-phosphate (1MEOX) (6TMS) BP
analyte InChI	InChI=1S/C25H64NO9PSi6/c1-28-26-20-22(30-37(2,3)4)24(32-39(8,9)10)25(33-40(11,12)13)23(31-38(5,6)7)21-29-36(27,34-41(14,15)16)35-42(17,18)19/h20,22-25H,21H2,1-19H3/b26-20-/t22-,23+,24+,25+/m0/s1
analyte mass	722.26
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	METB-METB
retention time (sec)
retention index (VAR5 method, n-alkanes C10–C36)	2,331.29 (predicted, according to Strehmel, N. et.al)
base peak (m/z)	73
maximal intensity	999
mass-intensity-peaks cardinality	272 intensities
minimal m/z	45
maximal m/z	561
download JCAMP DX	SpectrumJcampDx.ashx?id=5c02aa41-6299-40c5-9daa-50fdca3d4769
download MSP	SpectrumMsp.ashx?id=5c02aa41-6299-40c5-9daa-50fdca3d4769

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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