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MassBank Record: KO000251

D-Arabinose 5-phosphate; LC-ESI-QQ; MS2; CE:40 V; [M-H]-

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

ACCESSION: KO000251
RECORD_TITLE: D-Arabinose 5-phosphate; LC-ESI-QQ; MS2; CE:40 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 A147

CH$NAME: Arabinose 5-phosphate
CH$NAME: D-Arabinose 5-phosphate
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H11O8P
CH$EXACT_MASS: 230.01915
CH$SMILES: O=C[C@@H](O)[C@H](O)[C@H](O)COP(O)(O)=O
CH$IUPAC: InChI=1S/C5H11O8P/c6-1-3(7)5(9)4(8)2-13-14(10,11)12/h1,3-5,7-9H,2H2,(H2,10,11,12)/t3-,4-,5+/m1/s1
CH$LINK: CAS 13137-52-5
CH$LINK: CHEBI 16241
CH$LINK: KEGG C01112
CH$LINK: PUBCHEM SID:4344
CH$LINK: INCHIKEY PPQRONHOSHZGFQ-WDCZJNDASA-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 40 V

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

PK$SPLASH: splash10-004i-9000000000-585f803ae9cdd8a87b5b
PK$NUM_PEAK: 6
PK$PEAK: m/z int. rel.int.
  32.300 14851.5 1
  58.800 133663.5 8
  70.900 292079.5 18
  79.000 15910907.0 999
  97.000 5886144.5 370
  138.700 133663.5 8
//

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