ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008806
RECORD_TITLE: DODECANAL O-2,3,4,5,6-PENTAFLUOROBENZYLOXIME; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UOEH
LICENSE: CC BY-NC-SA

CH$NAME: DODECANAL O-2,3,4,5,6-PENTAFLUOROBENZYLOXIME
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₉H₂₆F₅NO
CH$EXACT_MASS: 379.19346
CH$SMILES: CCCCCCCCCCCC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1
CH$IUPAC: InChI=1S/C19H26F5NO/c1-2-3-4-5-6-7-8-9-10-11-12-25-26-13-14-15(20)17(22)19(24)18(23)16(14)21/h12H,2-11,13H2,1H3/b25-12-
CH$LINK: INCHIKEY KVESFPFADCWDQR-ROTLSHHCSA-N

AC$INSTRUMENT: HP 5970
AC$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$SPLASH: splash10-001l-9830000000-f02b600a2eee8ade6fd7
PK$NUM_PEAK: 69
PK$PEAK: m/z int. rel.int.
  41 30.26 303
  42 5.57 56
  43 28.27 283
  44 1.99 20
  46 1.61 16
  51 0.77 8
  53 2.19 22
  54 4.04 40
  55 16.52 165
  56 5.45 55
  57 12.48 125
  58 3.03 30
  59 0.97 10
  67 3.45 35
  68 2.47 25
  69 8.93 89
  70 3.12 31
  71 4.32 43
  72 1.6 16
  79 1.78 18
  80 1.03 10
  81 3.76 38
  82 4.87 49
  83 5.93 59
  84 1.73 17
  85 1.81 18
  86 1.66 17
  93 1.79 18
  95 2.75 28
  96 4.95 50
  97 5.91 59
  98 2.94 29
  99 3.31 33
  100 1.27 13
  109 1.45 15
  110 3.22 32
  111 2.61 26
  112 1.18 12
  117 2.13 21
  118 2.02 20
  124 1.93 19
  131 1.26 13
  138 1.36 14
  149 1.18 12
  150 1.96 20
  161 3.03 30
  167 2.24 22
  168 1.17 12
  176 1.25 13
  177 3.92 39
  178 1.45 15
  179 0.75 8
  181 99.99 999
  182 8.69 87
  194 1.15 12
  195 2.87 29
  196 1.6 16
  197 1.89 19
  198 11.57 116
  199 1.48 15
  202 1.78 18
  207 7.32 73
  208 0.76 8
  219 1.22 12
  222 5.69 57
  226 1.15 12
  239 46.07 461
  240 4.94 49
  252 2.9 29
//