ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008666
RECORD_TITLE: 2-AMYLCINNAMIC ALDEHYDE DIETHYL ACETAL; 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$NAME: 2-AMYLCINNAMIC ALDEHYDE DIETHYL ACETAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C18H28O2
CH$EXACT_MASS: 276.20893
CH$SMILES: CCCCCc(c1)c(ccc1)C([H])=C([H])C(OCC)OCC
CH$IUPAC: InChI=1S/C18H28O2/c1-4-7-8-11-16-12-9-10-13-17(16)14-15-18(19-5-2)20-6-3/h9-10,12-15,18H,4-8,11H2,1-3H3/b15-14+
CH$LINK: INCHIKEY PQARPKGSMQTPKR-CCEZHUSRSA-N
AC$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: splash10-0ke9-9850000000-05f0fee1ad3bd033f490
PK$NUM_PEAK: 92
PK$PEAK: m/z int. rel.int.
  15 1.01 10
  19 1.61 16
  27 21.5 215
  29 68.43 684
  30 1.25 13
  31 4.22 42
  39 6.32 63
  41 25.13 251
  42 1.3 13
  43 15.32 153
  45 2.95 30
  47 72.15 722
  51 3.26 33
  53 3.13 31
  55 11.6 116
  57 4.1 41
  59 3.85 39
  63 1.99 20
  65 4.47 45
  67 2.32 23
  69 5.41 54
  71 3.06 31
  75 57.79 578
  76 1.2 12
  77 8.29 83
  78 4.43 44
  79 5.31 53
  81 3.48 35
  83 1.61 16
  85 1.38 14
  89 2.42 24
  91 74.5 745
  92 4.77 48
  93 1 10
  95 2.24 22
  99 2.56 26
  102 2.97 30
  103 86.01 860
  104 7.36 74
  105 15.6 156
  106 1.25 13
  107 4.71 47
  113 1.05 11
  114 1.05 11
  115 37.72 377
  116 15.45 155
  117 42.69 427
  118 4.83 48
  119 6.41 64
  120 1.21 12
  127 4.65 47
  128 11.43 114
  129 44.08 441
  130 7.79 78
  131 25.17 252
  132 2.54 25
  133 3.32 33
  135 7.57 76
  136 1.03 10
  141 3.92 39
  142 1.56 16
  143 4.71 47
  144 1.39 14
  145 10.96 110
  146 1.5 15
  147 4.59 46
  149 5.24 52
  155 1.57 16
  157 2.11 21
  158 1.06 11
  159 2.46 25
  161 3.18 32
  173 6.85 69
  174 2.27 23
  175 3.8 38
  177 5.78 58
  178 1.21 12
  185 2.06 21
  201 3.89 39
  202 1.7 17
  203 4.91 49
  204 1.31 13
  205 93.07 931
  206 14.37 144
  207 1.25 13
  230 1.26 13
  231 99.99 999
  232 19.15 192
  233 1.71 17
  247 1.27 13
  276 9.75 98
  277 2.44 24
//
