ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008804
RECORD_TITLE: DECANAL 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$NAME: DECANAL O-2,3,4,5,6-PENTAFLUOROBENZYLOXIME
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₇H₂₂F₅NO
CH$EXACT_MASS: 351.16216
CH$SMILES: CCCCCCCCCC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1
CH$IUPAC: InChI=1S/C17H22F5NO/c1-2-3-4-5-6-7-8-9-10-23-24-11-12-13(18)15(20)17(22)16(21)14(12)19/h10H,2-9,11H2,1H3/b23-10+
CH$LINK: INCHIKEY NUGDFCWVLOJWOP-AUEPDCJTSA-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$SPLASH: splash10-001l-9830000000-4feacf9a1a4883f63d8b
PK$NUM_PEAK: 53
PK$PEAK: m/z int. rel.int.
  41 28.77 288
  42 4.83 48
  43 25.78 258
  44 0.87 9
  54 4.7 47
  55 15.59 156
  56 5.48 55
  57 10.94 109
  58 2.16 22
  67 3.02 30
  68 1.77 18
  69 9.65 97
  70 2.9 29
  71 3.38 34
  79 1.49 15
  81 3.79 38
  82 5.87 59
  83 6.67 67
  84 0.6 6
  85 0.84 8
  86 0.81 8
  93 0.96 10
  95 2.68 27
  96 6.25 63
  97 5.8 58
  98 3.2 32
  99 3.83 38
  110 3.86 39
  111 0.92 9
  117 2.71 27
  119 0.92 9
  124 2.06 21
  149 0.68 7
  150 1.25 13
  161 3.89 39
  167 1.01 10
  168 1.87 19
  177 4.46 45
  178 1.69 17
  181 99.99 999
  182 6.86 69
  184 6.56 66
  194 0.67 7
  195 4.08 41
  196 1.48 15
  197 2.53 25
  198 4.72 47
  202 0.66 7
  207 7.44 74
  222 4.71 47
  239 39.19 392
  240 3.05 31
  252 1.58 16
//