ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003501
RECORD_TITLE: 2-(3-(3-HYDROXYBENZOYL)PHENYL)PROPIONICACID METHYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 2-(3-(3-HYDROXYBENZOYL)PHENYL)PROPIONICACID METHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C17H16O4
CH$EXACT_MASS: 284.10486
CH$SMILES: COC(=O)C(C)c(c2)cc(cc2)C(=O)c(c1)cc(O)cc1
CH$IUPAC: InChI=1S/C17H16O4/c1-11(17(20)21-2)12-5-3-6-13(9-12)16(19)14-7-4-8-15(18)10-14/h3-11,18H,1-2H3
CH$LINK: INCHIKEY JJKBMVXFVHMUKK-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI M-60
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00c0-0590000000-4b8de8dab4fac0244d25
PK$NUM_PEAK: 69
PK$PEAK: m/z int. rel.int.
  43 0.61 6
  44 1.59 16
  55 0.71 7
  57 1.2 12
  59 1.32 13
  65 1.96 20
  69 0.19 2
  71 0.83 8
  73 0.94 9
  83 0.17 2
  85 0.15 2
  93 8.18 82
  99 0.69 7
  103 7.67 77
  104 2.77 28
  105 1.37 14
  106 0.53 5
  107 0.36 4
  109 0.56 6
  119 0.88 9
  120 0.32 3
  121 59.45 595
  122 4.06 41
  123 0.93 9
  131 12.05 121
  132 1.58 16
  133 0.84 8
  135 1.71 17
  141 0.27 3
  142 0.15 2
  147 0.6 6
  149 0.18 2
  163 1.08 11
  165 0.36 4
  167 0.18 2
  168 0.8 8
  169 0.3 3
  177 0.74 7
  178 0.68 7
  179 1.15 12
  181 2.32 23
  182 0.79 8
  191 28.53 285
  192 3.9 39
  193 0.27 3
  195 0.78 8
  196 1.84 18
  197 9.56 96
  198 1.54 15
  207 1.95 20
  208 0.78 8
  209 1.6 16
  210 5.18 52
  211 1.23 12
  223 2.41 24
  224 39.53 395
  225 99.99 999
  226 21.84 218
  227 1.66 17
  239 1.72 17
  240 0.93 9
  252 1.77 18
  253 0.14 1
  260 0.14 1
  281 0.18 2
  283 0.73 7
  284 65.22 652
  285 12.11 121
  286 1.53 15
//
