MassBank Record: KO000761



 Fructose 2,6-diphosphate; LC-ESI-QQ; MS2; CE:30 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO000761
RECORD_TITLE: Fructose 2,6-diphosphate; LC-ESI-QQ; MS2; CE:30 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 30 V
MS$FOCUSED_ION: PRECURSOR_M/Z 339 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0002-9830000000-a9cbb8a3dba391a8858b PK$NUM_PEAK: 24 PK$PEAK: m/z int. rel.int. 59.100 103960.5 112 66.700 9901.0 11 74.100 34653.5 37 79.100 138614.0 149 97.000 930694.0 999 99.000 69307.0 74 117.900 163366.5 175 136.900 34653.5 37 138.700 29703.0 32 141.400 29703.0 32 151.100 34653.5 37 155.100 24752.5 27 158.100 173267.5 186 158.800 94059.5 101 161.000 89109.0 96 163.700 14851.5 16 177.100 183168.5 197 180.900 39604.0 43 197.100 336634.0 361 207.100 9901.0 11 223.000 74257.5 80 241.100 435644.0 468 256.800 24752.5 27 339.300 44554.5 48 //