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MassBank Record: MSBNK-RIKEN_ReSpect-PS019702

D-Ribofuranose, D-(-)-Ribose, Rib; LC-ESI-QQ; MS2

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-RIKEN_ReSpect-PS019702
RECORD_TITLE: D-Ribofuranose, D-(-)-Ribose, Rib; LC-ESI-QQ; MS2
DATE: 2009.02.09
AUTHORS: Sawada Y, Matsuda F, and Hirai MY. Plant Science Center, RIKEN
LICENSE: CC BY-NC
COPYRIGHT: Copyright(C) 2008 Plant Science Center, RIKEN
PUBLICATION: Sawada, Y.; Akiyama, K.; Sakata, A.; Kuwahara, A.; Otsuki, H.; Sakurai, T.; Saito, K.; Hirai, M. Y. Widely Targeted Metabolomics Based on Large-Scale MS/MS Data for Elucidating Metabolite Accumulation Patterns in Plants. Plant and Cell Physiology 2008, 50 (1), 37–47. DOI:10.1093/pcp/pcn183
COMMENT: Build 5
COMMENT: Data acquisition and generation is financially supported in part by CREST/JST.
COMMENT: Source compound SIGMA, R7500.
COMMENT: PRIMe compound in-house ID 197
COMMENT: This spectra was automatically generated from the raw data without manual curation of data quality.
COMMENT: The spectral data and services are available to the research and academic community only.
COMMENT: All users must cite follwing literature in publication(s).

CH$NAME: D-Ribofuranose
CH$NAME: D-(-)-Ribose
CH$NAME: Rib
CH$COMPOUND_CLASS: CLASS1 Other CLASS2 Sugar CLASS3 Monosaccharide
CH$FORMULA: C5H10O5
CH$EXACT_MASS: 150.13
CH$SMILES: C(C1C(C(C(O1)O)O)O)O
CH$IUPAC: InChI=1S/C5H10O5/c6-1-2-3(7)4(8)5(9)10-2/h2-9H,1H2
CH$LINK: CAS 50-69-1
CH$LINK: KEGG C00121
CH$LINK: PUBCHEM CID:5779
CH$LINK: INCHIKEY HMFHBZSHGGEWLO-UHFFFAOYSA-N

AC$INSTRUMENT: TQD, Waters
AC$INSTRUMENT_TYPE: LC-ESI-QQ
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20

MS$FOCUSED_ION: ION_TYPE [M+H]+
MS$FOCUSED_ION: PRECURSOR_M/Z 151.16

PK$SPLASH: splash10-014i-9000000000-6015755acdc194650e4c
PK$NUM_PEAK: 4
PK$PEAK: m/z int. rel.int.
  68.0 17031.0 233
  69.0 72984.0 999
  89.0 13222.0 181
  90.0 7584.0 104
//

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