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MassBank Record: MSBNK-Keio_Univ-KO001751

Ribose 5-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: MSBNK-Keio_Univ-KO001751
RECORD_TITLE: Ribose 5-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 R002

CH$NAME: Ribose 5-phosphate
CH$NAME: alpha-D-Ribose 5-phosphate
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H11O8P
CH$EXACT_MASS: 230.01915
CH$SMILES: O[C@@H](O1)[C@H](O)[C@H](O)[C@H]1COP(O)(O)=O
CH$IUPAC: InChI=1S/C5H11O8P/c6-3-2(1-12-14(9,10)11)13-5(8)4(3)7/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5+/m1/s1
CH$LINK: KEGG C03736
CH$LINK: PUBCHEM SID:6499
CH$LINK: INCHIKEY KTVPXOYAKDPRHY-AIHAYLRMSA-N

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$SPLASH: splash10-0002-9300000000-a2b1ed753ae388a38031
PK$NUM_PEAK: 47
PK$PEAK: m/z int. rel.int.
  46.900 69307.0 2
  52.700 94059.5 3
  59.100 1420793.5 39
  61.500 44554.5 1
  66.700 89109.0 2
  67.500 9901.0 1
  70.900 128713.0 4
  75.300 396040.0 11
  77.200 64356.5 2
  78.900 7613869.0 208
  80.200 9901.0 1
  85.300 24752.5 1
  89.300 232673.5 6
  92.800 490099.5 13
  94.700 19802.0 1
  97.200 36495086.0 999
  99.100 4846539.5 133
  101.100 148515.0 4
  103.200 44554.5 1
  106.600 89109.0 2
  111.200 198020.0 5
  113.200 252475.5 7
  113.500 79208.0 2
  114.400 89109.0 2
  115.500 103960.5 3
  119.100 148515.0 4
  121.200 500000.5 14
  123.000 29703.0 1
  125.300 79208.0 2
  134.900 94059.5 3
  137.300 3524756.0 96
  139.200 6950502.0 190
  143.400 44554.5 1
  147.000 2539606.5 70
  151.400 89109.0 2
  153.200 24752.5 1
  157.100 74257.5 2
  165.400 1262377.5 35
  166.900 49505.0 1
  169.000 1475249.0 40
  173.100 24752.5 1
  174.800 9901.0 1
  193.000 613862.0 17
  196.900 103960.5 3
  210.900 64356.5 2
  228.100 19802.0 1
  229.300 3678221.5 101
//

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