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: 230.019149999999996225596987642347812652587890625
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.
  59.100 113861.5 4
  79.000 30089139.0 999
  85.300 34653.5 1
  87.300 84158.5 3
  96.400 123762.5 4
  96.900 15925758.5 529
  100.900 54455.5 2
  113.100 39604.0 1
  116.100 19802.0 1
  124.800 19802.0 1
  129.300 49505.0 2
  131.000 19802.0 1
  133.100 24752.5 1
  136.700 44554.5 1
  137.300 44554.5 1
  139.100 12019814.0 399
  147.200 2054457.5 68
  151.200 297030.0 10
  163.500 24752.5 1
  165.100 24752.5 1
  169.400 252475.5 8
  181.300 128713.0 4
  183.400 44554.5 1
  185.100 34653.5 1
  192.900 64356.5 2
  196.200 39604.0 1
  211.200 20599030.5 684
  229.000 8391097.5 279
//