MassBank Record: KO000746



 D-Fructose 6-phosphate; 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: KO000746
RECORD_TITLE: D-Fructose 6-phosphate; LC-ESI-QQ; MS2; CE:30 V; [M-H]-
DATE: 2016.01.19 (Created 2007.07.07, modified 2012.10.22)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID F001

CH$NAME: Fructose 6-phosphate CH$NAME: Neuberg ester CH$NAME: D-Fructose 6-phosphoric acid CH$NAME: D-Fructose 6-phosphate CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H13O9P CH$EXACT_MASS: 260.02972 CH$SMILES: OCC(O)(O1)C(O)C(O)C(COP(O)(O)=O)1 CH$IUPAC: InChI=1S/C6H13O9P/c7-2-6(10)5(9)4(8)3(15-6)1-14-16(11,12)13/h3-5,7-10H,1-2H2,(H2,11,12,13)/t3-,4-,5+,6?/m1/s1 CH$LINK: CAS 643-13-0 CH$LINK: CHEBI 15946 CH$LINK: KEGG C00085 CH$LINK: NIKKAJI J92.807K CH$LINK: PUBCHEM SID:3385
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: splash10-0002-9100000000-51c3f5ca7ef3f190f1df PK$NUM_PEAK: 54 PK$PEAK: m/z int. rel.int. 42.000 84158.5 2 45.300 153465.5 4 55.300 39604.0 1 59.100 18549523.5 479 61.100 321782.5 8 69.000 24752.5 1 71.200 202970.5 5 72.900 128713.0 3 77.100 198020.0 5 79.000 12089121.0 312 83.300 128713.0 3 85.300 44554.5 1 86.900 69307.0 2 88.800 103960.5 3 89.300 99010.0 3 90.700 19802.0 1 93.200 84158.5 2 94.800 108911.0 3 96.300 84158.5 2 97.000 38673306.0 999 99.100 148515.0 4 101.000 698020.5 18 103.000 94059.5 2 106.100 14851.5 1 107.000 217822.0 6 113.000 54455.5 1 115.000 272277.5 7 116.400 158416.0 4 117.100 297030.0 8 119.100 846535.5 22 120.300 79208.0 2 121.300 242574.5 6 126.700 9901.0 1 131.000 242574.5 6 133.000 29703.0 1 134.000 94059.5 2 135.400 29703.0 1 137.500 39604.0 1 139.300 2346537.0 61 140.900 148515.0 4 143.000 24752.5 1 145.200 84158.5 2 151.300 1039605.0 27 154.900 29703.0 1 161.200 143564.5 4 162.800 24752.5 1 169.000 188119.0 5 172.300 1470298.5 38 183.300 24752.5 1 198.800 148515.0 4 199.500 3272280.5 85 213.100 49505.0 1 227.100 69307.0 2 241.500 59406.0 2 //