MassBank Record: KO000744



 D-Fructose 6-phosphate; LC-ESI-QQ; MS2; CE:10 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO000744
RECORD_TITLE: D-Fructose 6-phosphate; LC-ESI-QQ; MS2; CE:10 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 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)C(O)C(O)C(O)COP(O)(O)=O CH$IUPAC: InChI=1S/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h4-7,9-11H,1-2H2,(H2,12,13,14)/t4-,5-,6-/m1/s1 CH$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$MASS_SPECTROMETRY: COLLISION_ENERGY 10 V
MS$FOCUSED_ION: PRECURSOR_M/Z 259 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0aor-0690000000-b640c7fba12f06d6bfa2 PK$NUM_PEAK: 65 PK$PEAK: m/z int. rel.int. 59.100 1455447.0 13 68.900 19802.0 1 77.100 1529704.5 13 79.100 371287.5 3 82.000 39604.0 1 87.000 89109.0 1 91.200 475248.0 4 92.800 99010.0 1 95.300 1386140.0 12 97.100 7163373.5 62 100.900 89109.0 1 104.900 1311882.5 11 109.000 509901.5 4 113.000 673268.0 6 115.300 599010.5 5 115.600 24752.5 1 117.000 306931.0 3 118.500 1490100.5 13 119.000 59722832.0 516 123.300 331683.5 3 127.000 247525.0 2 128.500 44554.5 1 131.200 257426.0 2 132.200 24752.5 1 133.200 490099.5 4 135.800 29703.0 1 137.100 4019806.0 35 138.800 430693.5 4 140.900 1009902.0 9 141.400 262376.5 2 142.900 108911.0 1 147.800 44554.5 1 148.900 19802.0 1 151.200 5445550.0 47 152.600 49505.0 1 154.700 193069.5 2 157.400 24752.5 1 161.300 445545.0 4 164.600 19802.0 1 169.100 2217824.0 19 172.100 297030.0 3 172.700 79208.0 1 176.100 19802.0 1 176.600 39604.0 1 178.700 14851.5 1 181.000 19802.0 1 182.900 554456.0 5 186.900 79208.0 1 191.100 183168.5 2 197.400 69307.0 1 198.600 247525.0 2 199.300 10881199.0 94 200.900 34653.5 1 205.300 153465.5 1 209.100 118812.0 1 213.100 89109.0 1 215.100 89109.0 1 216.400 212871.5 2 221.300 821783.0 7 223.200 717822.5 6 227.000 237624.0 2 238.800 14851.5 1 241.100 5504956.0 48 241.900 44554.5 1 259.100 115519917.5 999 //