ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005370
RECORD_TITLE: (Z)-7-HEXADECENYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAOKA R, KYOTO INSTITUTE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: (Z)-7-HEXADECENYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₈H₃₄O₂
CH$EXACT_MASS: 282.25588
CH$SMILES: CCCCCCCCC([H])=C([H])CCCCCCOC(C)=O
CH$IUPAC: InChI=1S/C18H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18(2)19/h10-11H,3-9,12-17H2,1-2H3/b11-10-
CH$LINK: INCHIKEY QVXFGVVYTKZLJN-KHPPLWFESA-N

AC$INSTRUMENT: SHIMADZU QP-1000
AC$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$SPLASH: splash10-00kg-9100000000-88a8e6bacc340e3496b7
PK$NUM_PEAK: 66
PK$PEAK: m/z int. rel.int.
  41 8 80
  42 1.8 18
  43 48.7 487
  44 99.99 999
  45 13.9 139
  46 59.4 594
  47 1.5 15
  54 2.7 27
  55 48.5 485
  56 11.9 119
  57 17.9 179
  58 0.66 7
  59 8.3 83
  61 8.3 83
  65 1.5 15
  66 0.42 4
  67 45.5 455
  68 24.4 244
  69 25.4 254
  70 0.77 8
  71 5.6 56
  72 3 30
  73 7.7 77
  75 0.13 1
  77 1.5 15
  79 5.2 52
  80 3.5 35
  81 3.47 35
  82 42.7 427
  83 17.7 177
  84 3 30
  85 0.19 2
  86 2.3 23
  87 6.2 62
  88 2.3 23
  89 1 10
  93 1.5 15
  94 1.8 18
  95 25.1 251
  96 3.48 35
  97 12.8 128
  98 2.2 22
  101 2.1 21
  102 0.22 2
  103 4.7 47
  108 3 30
  109 17.6 176
  110 1.33 13
  111 5.1 51
  112 1.1 11
  117 1.3 13
  122 0.15 2
  123 8.5 85
  124 9 90
  125 2.2 22
  131 0.13 1
  133 3.8 38
  137 4.7 47
  138 5.3 53
  147 0.14 1
  151 1.4 14
  165 1.6 16
  166 2.6 26
  194 0.22 2
  222 9.8 98
  223 1.9 19
//