MassBank Record: KO001766

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Ribose 1-phosphate; LC-ESI-QQ; MS2; CE:20 V; [M-H]-

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

ACCESSION: KO001766
RECORD_TITLE: Ribose 1-phosphate; LC-ESI-QQ; MS2; CE:20 V; [M-H]-
DATE: 2016.01.19 (Created 2007.07.07, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID R017

CH$NAME: Ribose 1-phosphate
CH$NAME: alpha-D-Ribose 1-phosphate
CH$NAME: D-Ribose 1-phosphate
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H11O8P
CH$EXACT_MASS: 230.01915
CH$SMILES: OCC(O1)C(O)C(O)C1OP(O)(O)=O
CH$IUPAC: InChI=1S/C5H11O8P/c6-1-2-3(7)4(8)5(12-2)13-14(9,10)11/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5-/m1/s1
CH$LINK: CAS 14075-00-4
CH$LINK: CHEBI 4236
CH$LINK: INCHIKEY YXJDFQJKERBOBM-TXICZTDVSA-N
CH$LINK: KEGG C00620
CH$LINK: PUBCHEM SID:3894

AC$INSTRUMENT: API3000, Applied Biosystems
AC$INSTRUMENT_TYPE: LC-ESI-QQ
AC$MASS_SPECTROMETRY: MS_TYPE: MS2
AC$MASS_SPECTROMETRY: ION_MODE: NEGATIVE
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20 V

MS$FOCUSED_ION: PRECURSOR_M/Z 229
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-

PK$SPLASH: splash10-01t9-9250000000-029c27941ed85100b53c
PK$NUM_PEAK: 28
PK$PEAK: m/z int. rel.int.
  59.1 113862.0 4.0
  79.0 3.00891E7 999.0
  85.3 34653.5 1.0
  87.3 84158.5 3.0
  96.4 123762.0 4.0
  96.9 1.59258E7 529.0
  100.9 54455.5 2.0
  113.1 39604.0 1.0
  116.1 19802.0 1.0
  124.8 19802.0 1.0
  129.3 49505.0 2.0
  131.0 19802.0 1.0
  133.1 24752.5 1.0
  136.7 44554.5 1.0
  137.3 44554.5 1.0
  139.1 1.20198E7 399.0
  147.2 2054460.0 68.0
  151.2 297030.0 10.0
  163.5 24752.5 1.0
  165.1 24752.5 1.0
  169.4 252476.0 8.0
  181.3 128713.0 4.0
  183.4 44554.5 1.0
  185.1 34653.5 1.0
  192.9 64356.5 2.0
  196.2 39604.0 1.0
  211.2 2.0599E7 684.0
  229.0 8391100.0 279.0
//