ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002377
RECORD_TITLE: 1-BENZYLOXY-4-METHYLENE-5-HEXEN-2-OL; 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$NAME: 1-BENZYLOXY-4-METHYLENE-5-HEXEN-2-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₁₈O₂
CH$EXACT_MASS: 218.13068
CH$SMILES: C=CC(=C)CC(O)COCc(c1)cccc1
CH$IUPAC: InChI=1S/C14H18O2/c1-3-12(2)9-14(15)11-16-10-13-7-5-4-6-8-13/h3-8,14-15H,1-2,9-11H2
CH$LINK: INCHIKEY JWRUCASEZDOQPK-UHFFFAOYSA-N

AC$INSTRUMENT: JEOL JMS-D-3000
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0006-9100000000-b5dfe3567eac804c3cf2
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
  41 22.6 226
  43 5.95 60
  51 3.31 33
  53 4.34 43
  55 1.71 17
  63 1.88 19
  65 10.62 106
  67 5.95 60
  68 6.99 70
  69 10.85 109
  77 3.45 35
  79 7.24 72
  81 6.83 68
  83 1.87 19
  89 1.86 19
  91 99.99 999
  92 17.2 172
  94 2.57 26
  95 2.31 23
  97 2.8 28
  107 6.49 65
  109 5.64 56
  112 2.06 21
  113 2.62 26
  114 2.85 29
  126 6.33 63
  127 5.42 54
  143 4.01 40
  169 1.72 17
  187 2.88 29
  218 0.38 4
//