MassBank Record: KO000763



 Fructose 2,6-diphosphate; LC-ESI-QQ; MS2; CE:50 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO000763
RECORD_TITLE: Fructose 2,6-diphosphate; LC-ESI-QQ; MS2; CE:50 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 F010

CH$NAME: Fructose 2,6-diphosphate CH$NAME: D-Fructose 2,6-bisphosphate CH$NAME: beta-D-Fructose 2,6-bisphosphate CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H14O12P2 CH$EXACT_MASS: 339.99605 CH$SMILES: OCC(O1)(C(O)C(O)C(COP(O)(O)=O)1)OP(O)(O)=O CH$IUPAC: InChI=1S/C6H14O12P2/c7-2-6(18-20(13,14)15)5(9)4(8)3(17-6)1-16-19(10,11)12/h3-5,7-9H,1-2H2,(H2,10,11,12)(H2,13,14,15)/t3-,4-,5+,6+/m1/s1 CH$LINK: CHEBI 28602 CH$LINK: KEGG C00665 CH$LINK: PUBCHEM SID:3934
AC$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 50 V
MS$FOCUSED_ION: PRECURSOR_M/Z 339 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-004j-9100000000-9851b59e56acb7c5802c PK$NUM_PEAK: 14 PK$PEAK: m/z int. rel.int. 42.400 9901.0 11 59.000 89109.0 98 71.600 19802.0 22 78.900 910892.0 999 81.000 24752.5 27 84.600 14851.5 16 92.600 39604.0 43 96.900 608911.5 668 98.700 103960.5 114 115.200 24752.5 27 118.100 118812.0 130 118.600 34653.5 38 159.100 79208.0 87 160.800 39604.0 43 //