ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009357
RECORD_TITLE: 1-DIETHOXYPHOSPHORYL-4-HYDROXY-NONAN-2-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KANEMASA S, INST. OF ADVANCED MATERIAL STUDY KYUSHU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 1-DIETHOXYPHOSPHORYL-4-HYDROXY-NONAN-2-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H27O5P
CH$EXACT_MASS: 294.15961
CH$SMILES: CCCCCC(O)CC(=O)CP(=O)(OCC)OCC
CH$IUPAC: InChI=1S/C13H27O5P/c1-4-7-8-9-12(14)10-13(15)11-19(16,17-5-2)18-6-3/h12,14H,4-11H2,1-3H3
CH$LINK: INCHIKEY GOWXDWHMDPJXEG-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-01-SG-2
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00di-3940000000-e54190f7674e291b4589
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
  38 6.19 62
  40 14.97 150
  42 15.12 151
  43 5.98 60
  44 6.8 68
  55 10.7 107
  65 8.19 82
  81 11 110
  96 7.64 76
  97 15.89 159
  105 5.45 55
  108 5.59 56
  109 10.01 100
  121 10.4 104
  123 25.2 252
  124 5.22 52
  125 19.52 195
  138 6.85 69
  139 18.52 185
  149 7.42 74
  151 15.95 160
  152 18.14 181
  167 17.31 173
  179 19.14 191
  194 42.09 421
  195 36.33 363
  223 99.99 999
  224 9.41 94
  225 2.39 24
  228 1.58 16
  233 3.44 34
  236 1.82 18
  247 1.52 15
  248 1.13 11
  249 2.73 27
  276 5.64 56
  277 1.47 15
  294 3.3 33
//
