MassBank Record: KO001755



 Ribulose 1,5-diphosphate; 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: KO001755
RECORD_TITLE: Ribulose 1,5-diphosphate; LC-ESI-QQ; MS2; CE:10 V; [M-H]-
DATE: 2016.01.19 (2007.07.07, 2011.05.10)
AUTHORS: Kakazu YInstitute for Advanced Biosciences, Keio Univ., Horai HInstitute for Advanced Biosciences, Keio Univ., Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID R005

CH$NAME: Ribulose 1,5-diphosphate CH$NAME: D-Ribulose 1,5-bisphosphate CH$COMPOUND_CLASS: N/A CH$FORMULA: C5H12O11P2 CH$EXACT_MASS: 309.98548 CH$SMILES: O[C@H](COP(O)(O)=O)[C@@H](O)C(=O)COP(O)(O)=O CH$IUPAC: InChI=1S/C5H12O11P2/c6-3(1-15-17(9,10)11)5(8)4(7)2-16-18(12,13)14/h3,5-6,8H,1-2H2,(H2,9,10,11)(H2,12,13,14)/t3-,5-/m1/s1 CH$LINK: CAS 24218-00-6 CH$LINK: CHEBI 16710 CH$LINK: KEGG C01182 CH$LINK: PUBCHEM SID:4409 CH$LINK: INCHIKEY YAHZABJORDUQGO-NQXXGFSBSA-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$MASS_SPECTROMETRY: COLLISION_ENERGY 10 V
MS$FOCUSED_ION: PRECURSOR_M/Z 309 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0a4i-0019000000-fd45006df49c45fccf38 PK$NUM_PEAK: 15 PK$PEAK: m/z int. rel.int. 59.100 148515.0 16 97.100 222772.5 23 127.300 39604.0 4 128.800 29703.0 3 211.100 59406.0 6 217.200 29703.0 3 241.200 59406.0 6 244.700 9901.0 1 249.000 79208.0 8 265.300 39604.0 4 271.300 163366.5 17 273.100 118812.0 13 277.300 732674.0 77 290.700 54455.5 6 309.200 9470306.5 999 //