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Levulinic acid, 5-amino- (1MEOX) (3TMS) BP

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Replica Mass Spectra of Levulinic acid, 5-amino- (1MEOX) (3TMS) BP

replica	lib entry date	detection	method	species
1	19 July 2007	MS-TOF	MDN35	Reference Substance
2	19 July 2007	MS-TOF	VAR5	Reference Substance
8	28 August 2012		MassBank GC 2010 Tsujimoto
7	28 August 2012		MassBank GC 2010 Kusano
10	05 June 2013		MRI_2013
9	28 August 2012		MassBank GC 2010 Ara
4	22 February 2005	MS-TOF	M[STR]
6	03 November 2010		Schomburg_GC_2010
5	01 September 2001	MS-TOF	M[EIGTMS]	Saccharomyces cerevisiae
9 spectrum(a)

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Spectrum Details

analyte	Levulinic acid, 5-amino- (1MEOX) (3TMS) BP
analyte InChI
analyte mass	376.71
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)	1,527.06
retention index (VAR5 method, n-alkanes C10–C36)	1,779.74 (predicted, according to Strehmel, N. et.al)
base peak (m/z)	174
maximal intensity	999
mass-intensity-peaks cardinality	142 intensities
minimal m/z	45
maximal m/z	363
download JCAMP DX	SpectrumJcampDx.ashx?id=2df34e6d-a854-4f41-810e-3175fb9940ae
download MSP	SpectrumMsp.ashx?id=2df34e6d-a854-4f41-810e-3175fb9940ae

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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