| ReSpect |
ACCESSION
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alpha-L-(-)-Fucose 1-phosphate bis(cyclohexylammonium) salt ; MS2; QqQ; positive; CE 10 V
2009.2.9 Copyright(C) 2008 Plant Science Center, RIKEN
Record Data
| Tag | Sub Tag | Data |
|---|---|---|
| ACCESSION | PS123201 | |
| RECORD_TITLE | alpha-L-(-)-Fucose 1-phosphate bis(cyclohexylammonium) salt ; MS2; QqQ; positive; CE 10 V | |
| DATE | 2009.2.9 | |
| AUTHORS | Sawada Y, Matsuda F, and Hirai MY. Plant Science Center, RIKEN | |
| COPYRIGHT | Copyright(C) 2008 Plant Science Center, RIKEN | |
| COMMENTS | Build 5 | |
| COMMENTS | Data acquisition and generation is financially supported in part by CREST/JST. | |
| COMMENTS | Source compound SIGMA, F1759. | |
| COMMENTS | PRIMe compound in-house ID V0106 | |
| COMMENTS | This spectra was automatically generated from the raw data without manual curation of data quality. | |
| COMMENTS | The spectral data and services are available to the research and academic community only. | |
| COMMENTS | All users must cite follwing literature in publication(s). | |
| PUBLICATION | Sawada et al Widely targeted metabolomics based on large-scale MS/MS data for elucidating metabolite accumulation patterns in plants. Plant Cell Physiol(2009) 50:37-47:doi:10.1093/pcp/pcn183 | |
| STRUCTURE_FILE_NAME | N/A | |
| CH$ NAME | alpha-L-(-)-Fucose 1-phosphate bis(cyclohexylammonium) salt | |
| CH$ NAME | alpha-Fuc-1P | |
| CH$ NAME | alpha-Fucopyranosyl phosphate | |
| CH$ NAME | 6-Deoxy-alpha-L-galactose phosphate | |
| CH$ COMPOUND_CLASS | CLASS1 | Other |
| CH$ COMPOUND_CLASS | CLASS2 | Suger phosphate |
| CH$ COMPOUND_CLASS | CLASS3 | Galactose phosphate |
| CH$ FORMULA | C6H13O8P | |
| CH$ EXACT_MASS | 244.034 | |
| CH$ LINK | CAS | 24333-03-7 |
| CH$ LINK | KEGG | - |
| CH$ LINK | PUBCHEM |
CID 439397
|
| CH$ SMILES | CC1C(C(C(C(O1)OP(=O)(O)O)O)O)O | |
| CH$ INCHI | InChI=1/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/t2-,3+,4+,5-,6-/m0/s1/f/h10-11H | |
| CH$ IUPAC | [(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl] dihydrogen phosphate | |
| AC$ INSTRUMENT | TQD, Waters | |
| AC$ INSTRUMENT_TYPE | N/A | |
| AC$ ANALYTICAL_CONDITION | MS_TYPE | Flow-injection QqQ/MS |
| AC$ ANALYTICAL_CONDITION | IONIZATION | ESI |
| AC$ ANALYTICAL_CONDITION | PRECURSOR_SELECTION | Q |
| AC$ ANALYTICAL_CONDITION | FRAGMENTATION_EQUIPMENT | Q |
| AC$ ANALYTICAL_CONDITION | FRAGMENTATION_METHOD | LOW-ENERGY CID |
| AC$ ANALYTICAL_CONDITION | COLLISION_ENERGY | 10 |
| AC$ ANALYTICAL_CONDITION | SPECTRUM_TYPE | Q |
| AC$ ANALYTICAL_CONDITION | DATAFORMAT | CENTROID |
| AC$ ANALYTICAL_CONDITION | MODE | POSITIVE |
| MS$ FOCUSED_ION | ION_TYPE | [M+H]+ |
| MS$ FOCUSED_ION | PRECURSOR_M/Z | 245.24 |
| PK$ NUM_PEAK | 7 | |
| PK$ PEAK |
m/z int. rel.int. ![[-]](/menta.cgi/static/respect/images/iconMinus.gif){kind=small} m/z
Intensity
Relative intensity
75
3457
48
98
11065
155
99
70878
999
128
3883
54
129
14854
209
147
4883
68
245
4235
59
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