ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004580
RECORD_TITLE: METHYL (Z)-10-PENTADECENOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAYASHI A, DEPT. OF CHEMISTRY, FAC. OF SCI. AND TECHNOLOGY, KINKI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: METHYL (Z)-10-PENTADECENOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₃₀O₂
CH$EXACT_MASS: 254.22458
CH$SMILES: CCCCC=CCCCCCCCCC(=O)OC
CH$IUPAC: InChI=1S/C16H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18-2/h6-7H,3-5,8-15H2,1-2H3/b7-6-
CH$LINK: INCHIKEY JEDIPLFNJDRCFD-SREVYHEPSA-N

AC$INSTRUMENT: JEOL JMS-HX-100
AC$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$SPLASH: splash10-0awa-9200000000-e19e54480862687b5a6c
PK$NUM_PEAK: 78
PK$PEAK: m/z int. rel.int.
  45 2.63 26
  53 7.46 75
  54 19 190
  55 99.99 999
  56 21.51 215
  57 12.53 125
  59 14.59 146
  65 1.88 19
  66 1.58 16
  67 24.79 248
  68 18.12 181
  69 52.9 529
  70 13.43 134
  71 4.78 48
  73 5.28 53
  74 63.27 633
  75 8.11 81
  77 1.73 17
  79 5.24 52
  80 3.55 36
  81 23.29 233
  82 16.93 169
  83 35.43 354
  84 30.87 309
  85 5.99 60
  87 41.53 415
  88 4.34 43
  91 1.73 17
  93 3.02 30
  94 3.9 39
  95 17.6 176
  96 27.75 278
  97 28 280
  98 23.75 238
  99 3.51 35
  101 6.74 67
  107 2.3 23
  108 2.59 26
  109 9.56 96
  110 15.26 153
  111 12.48 125
  112 5.04 50
  113 3.4 34
  114 4.46 45
  115 6.86 69
  119 2.22 22
  121 2.8 28
  122 1.71 17
  123 11.94 119
  124 9.38 94
  125 7.73 77
  126 1.55 16
  127 4.13 41
  128 4.18 42
  129 3.84 38
  133 2.09 21
  134 1.41 14
  135 2.65 27
  137 7.02 70
  138 12.55 126
  139 5.79 58
  141 4.38 44
  143 2.46 25
  147 1.56 16
  149 1.43 14
  151 4.14 41
  152 4.18 42
  153 1.72 17
  165 2.37 24
  178 3.99 40
  179 3 30
  180 14.23 142
  181 2.82 28
  193 1.55 16
  222 14.64 146
  223 10.36 104
  224 1.5 15
  254 2.82 28
//