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MassBank Record: KO001459

alpha-D-(+)-mannose 1-phosphate; LC-ESI-QQ; MS2; CE:30 V; [M-H]-

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

ACCESSION: KO001459
RECORD_TITLE: alpha-D-(+)-mannose 1-phosphate; LC-ESI-QQ; MS2; CE:30 V; [M-H]-
DATE: 2016.01.19 (Created 2010.02.10, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID M080

CH$NAME: Mannose 1-phosphate
CH$NAME: alpha-D-(+)-mannose 1-phosphate
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H13O9P
CH$EXACT_MASS: 260.02972
CH$SMILES: OC[C@@H](O1)[C@@H](O)[C@H](O)[C@H](O)[C@H]1OP(O)(O)=O
CH$IUPAC: InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5+,6-/m1/s1
CH$LINK: KEGG C00636
CH$LINK: INCHIKEY HXXFSFRBOHSIMQ-RWOPYEJCSA-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 30 V

MS$FOCUSED_ION: PRECURSOR_M/Z 259
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-

PK$SPLASH: splash10-002b-9000000000-fadda0eb1812134ec29c
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  45.400 24752.5 1
  59.000 277228.0 9
  72.900 34653.5 1
  74.900 29703.0 1
  79.000 16465363.0 534
  83.200 59406.0 2
  87.200 44554.5 1
  97.000 30777258.5 999
  104.700 69307.0 2
  105.200 89109.0 3
  117.000 64356.5 2
  139.300 74257.5 2
  142.200 29703.0 1
  148.100 44554.5 1
  150.600 29703.0 1
  161.000 24752.5 1
  199.500 495050.0 16
  213.500 54455.5 2
  259.400 212871.5 7
//

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