ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003503
RECORD_TITLE: 2-(3-(4-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$NAME: 2-(3-(4-HYDROXYBENZOYL)PHENYL)PROPIONICACID METHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₇H₁₆O₄
CH$EXACT_MASS: 284.10486
CH$SMILES: COC(=O)C(C)c(c2)cc(cc2)C(=O)c(c1)ccc(O)c1
CH$IUPAC: InChI=1S/C17H16O4/c1-11(17(20)21-2)13-4-3-5-14(10-13)16(19)12-6-8-15(18)9-7-12/h3-11,18H,1-2H3
CH$LINK: INCHIKEY HUEPRCAJXIOEHP-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$SPLASH: splash10-00fr-0980000000-2cbc6c9b8f1a39fe9fc8
PK$NUM_PEAK: 62
PK$PEAK: m/z int. rel.int.
  40 0.72 7
  41 1.26 13
  44 2.48 25
  55 2.62 26
  56 1.4 14
  71 0.9 9
  73 1.38 14
  81 0.79 8
  82 0.38 4
  93 3.61 36
  98 0.19 2
  103 3.56 36
  104 1.16 12
  105 1.32 13
  119 0.84 8
  120 1.06 11
  121 99.99 999
  122 6.95 70
  123 0.94 9
  131 5.14 51
  132 0.44 4
  135 10.03 100
  141 0.45 5
  142 0.49 5
  147 0.39 4
  149 3.48 35
  163 0.46 5
  165 6 60
  167 0.69 7
  168 0.56 6
  169 0.4 4
  181 0.26 3
  191 10.15 102
  192 0.87 9
  193 2.04 20
  197 7.91 79
  198 1.15 12
  207 1.39 14
  208 0.77 8
  209 0.52 5
  210 3.28 33
  211 1.27 13
  221 0.15 2
  223 1.2 12
  224 4.91 49
  225 64.55 646
  226 11.73 117
  227 1 10
  235 0.55 6
  239 4.36 44
  240 1.41 14
  252 1.38 14
  253 1.02 10
  255 0.93 9
  267 0.47 5
  270 0.3 3
  281 0.37 4
  282 0.32 3
  283 0.66 7
  284 49.88 499
  285 10.59 106
  286 0.99 10
//