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Salicylaldehyde-beta-D-glucopyranoside (1MEOX) (4TMS) MP

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Replica Mass Spectra of Salicylaldehyde-beta-D-glucopyranoside (1MEOX) (4TMS) MP

replica	lib entry date	detection	method	species
1	07 September 2004	MS-Quad	M[2]	Standard
3	15 March 2005	MS-TOF	M[6]	Reference Substance
4	19 July 2007	MS-TOF	VAR5	Reference Substance
3 spectrum(a)

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Spectrum Details

analyte	Salicylaldehyde-beta-D-glucopyranoside (1MEOX) (4TMS) MP
analyte InChI	InChI=1S/C26H51NO7Si4/c1-28-27-18-20-16-14-15-17-21(20)30-26-25(34-38(11,12)13)24(33-37(8,9)10)23(32-36(5,6)7)22(31-26)19-29-35(2,3)4/h14-18,22-26H,19H2,1-13H3/b27-18+/t22-,23-,24+,25-,26-/m1/s1
analyte mass	602.03
chromatogram	6030hf_33
citation
authors	Boelling C, Liebig F, Erban A, Kopka 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 date	19 July 2007
metabolite role	METB
retention time (sec)	860.88
retention index (VAR5 method, n-alkanes C10–C36)
base peak (m/z)	73
maximal intensity	2,055,812
mass-intensity-peaks cardinality	430 intensities
minimal m/z	45
maximal m/z	1,000
download JCAMP DX	SpectrumJcampDx.ashx?id=dd04b3de-980c-45e8-b8d2-7fb134e0ca60
download MSP	SpectrumMsp.ashx?id=dd04b3de-980c-45e8-b8d2-7fb134e0ca60

GC-Method

name	MDN35
citation	Kopka J, Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany

attribute	text	details
deconvolution	ChromaTOF	BASELINE OFFSET: 1; SMOOTHING: 5; PEAK WIDTH: 3s; S/N: 10
derivatization	MEOX; MSTFA	METHOXYAMINATION: 120min at 37°C; TRIMETHYLSILYLATION: 30min at 37°C
detector	MS-TOF	m/z = 70-600; scans:20/s;
extraction	chloroform:dH2O	(2:1; v/v); chloroform (20°C); dH2O (4°C)
ion source	EI	70eV
RI	FAME, d6-Cholesterole	FAME: C8, C9, C10, C12, C14, C16, C18, C20, C22, C24, C26, C28, C30
separation	GC	COLUMN:35%phenyl-65%dimethylpolysiloxane, 30m, ID:0.32mm, DF:0.25µm, MDN-35 (Macherey-Nagel, Düren, Germany); PROGRAM:iso 2min 80°C, ramp 15°C/min, iso 6min 330°C; FLOW:Helium, 2mL/min; INJECTION:1µL, splitless, 230°C; TRANSFER:250°C; IONSOURCE:250°C

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