ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008719
RECORD_TITLE: CYCLOPENTADECANOLIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: CYCLOPENTADECANOLIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₂₈O₂
CH$EXACT_MASS: 240.20893
CH$SMILES: O=C(C1)OCCCCCCCCCCCCC1
CH$IUPAC: InChI=1S/C15H28O2/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-17-15/h1-14H2
CH$LINK: INCHIKEY FKUPPRZPSYCDRS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6044359

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-052f-9100000000-d4c22e0ccf95d372054e
PK$NUM_PEAK: 90
PK$PEAK: m/z int. rel.int.
  27 19.08 191
  29 33.72 337
  30 1.13 11
  31 2.7 27
  39 17.99 180
  41 99.99 999
  42 29.71 297
  43 40.8 408
  44 1.58 16
  45 2.79 28
  53 7.31 73
  54 14.16 142
  55 98.81 988
  56 29.3 293
  57 21.49 215
  58 5.47 55
  59 3 30
  60 7.71 77
  61 3.14 31
  65 1.15 12
  66 1.66 17
  67 21.32 213
  68 23.75 238
  69 55.28 553
  70 18.32 183
  71 13.37 134
  72 1.29 13
  73 13.35 134
  74 1.51 15
  79 3.21 32
  80 2.64 26
  81 19.4 194
  82 30.35 304
  83 40.37 404
  84 22.7 227
  85 4.75 48
  87 3.94 39
  93 1.8 18
  94 2.9 29
  95 13.3 133
  96 26.59 266
  97 26.68 267
  98 22.53 225
  99 2.81 28
  100 3.3 33
  101 4.76 48
  102 1.05 11
  107 1.25 13
  108 1.9 19
  109 6.99 70
  110 14.42 144
  111 11.29 113
  112 5.23 52
  113 2.57 26
  114 6.1 61
  115 3.47 35
  116 3.62 36
  121 1.42 14
  122 1.64 16
  123 6.23 62
  124 6.94 69
  125 5.31 53
  126 1.9 19
  127 3.23 32
  128 1.37 14
  129 3.78 38
  133 1.12 11
  134 1.15 12
  135 1.41 14
  136 1.18 12
  137 4.12 41
  138 6.27 63
  139 3.02 30
  140 1.14 11
  141 1.53 15
  151 2.92 29
  152 3.81 38
  153 1.5 15
  155 1.02 10
  158 1.1 11
  165 1.67 17
  172 1.52 15
  178 2.75 28
  179 1.67 17
  180 5.74 57
  181 1.42 14
  194 1.52 15
  222 5.7 57
  223 1.14 11
  240 4.15 42
//