ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010207
RECORD_TITLE: 5-PHENETHYL-3-STYRYL-2-ISOXAZOLINE; 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$NAME: 5-PHENETHYL-3-STYRYL-2-ISOXAZOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₉H₁₉NO
CH$EXACT_MASS: 277.14666
CH$SMILES: c(c3)ccc(c3)CCC(O1)CC(C=Cc(c2)cccc2)=N1
CH$IUPAC: InChI=1S/C19H19NO/c1-3-7-16(8-4-1)11-13-18-15-19(21-20-18)14-12-17-9-5-2-6-10-17/h1-11,13,19H,12,14-15H2/b13-11+
CH$LINK: INCHIKEY SNDAIAGNNKHSOS-ACCUITESSA-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$SPLASH: splash10-004l-8970000000-9f1a3114c3df64f133e1
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  39 7.09 71
  41 9.96 100
  50 4.25 43
  51 12.12 121
  63 7.23 72
  65 17.68 177
  76 5.08 51
  77 44.43 444
  78 12.09 121
  79 7.72 77
  89 5.64 56
  91 71.52 715
  92 8.7 87
  102 9.94 99
  103 39.15 392
  104 14.43 144
  105 16.22 162
  106 4.08 41
  115 23.3 233
  116 5.92 59
  117 6.61 66
  127 3.86 39
  128 12.12 121
  129 10.24 102
  130 8.55 86
  142 4.88 49
  143 25.68 257
  144 16.58 166
  172 12.17 122
  276 99.99 999
  277 65.49 655
  278 10.57 106
//