ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009201
RECORD_TITLE: 10-UNDECENOIC ACID; 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$NAME: 10-UNDECENOIC ACID
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₂₀O₂
CH$EXACT_MASS: 184.14633
CH$SMILES: C=CCCCCCCCCC(O)=O
CH$IUPAC: InChI=1S/C11H20O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2H,1,3-10H2,(H,12,13)
CH$LINK: COMPTOX DTXSID8035001
CH$LINK: INCHIKEY FRPZMMHWLSIFAZ-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:5634

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$SPLASH: splash10-0a7l-9000000000-830e35fcbdcb4ba9b574
PK$NUM_PEAK: 66
PK$PEAK: m/z int. rel.int.
  26 1.4 14
  27 24.4 244
  28 5.17 52
  29 28.55 286
  31 2.21 22
  39 27.69 277
  40 3.55 36
  41 79.93 799
  42 15.7 157
  43 21.91 219
  45 13.79 138
  51 1.32 13
  53 8.64 86
  54 16 160
  55 99.99 999
  56 19.6 196
  57 7.72 77
  58 1.65 17
  59 5.13 51
  60 26.24 262
  61 2.31 23
  65 1.07 11
  66 1.21 12
  67 14.63 146
  68 23.96 240
  69 44.46 445
  70 11.37 114
  71 3.92 39
  73 24.22 242
  74 2.29 23
  79 2.33 23
  80 2.42 24
  81 12.81 128
  82 26.26 263
  83 32.15 322
  84 21.26 213
  85 2.51 25
  86 1.02 10
  87 5.5 55
  93 1.1 11
  94 2.41 24
  95 7.05 71
  96 22.53 225
  97 13.49 135
  98 10.23 102
  99 2.29 23
  100 7.48 75
  101 5.18 52
  102 1.02 10
  109 2.83 28
  110 5.53 55
  111 3.04 30
  112 1.53 15
  113 1.96 20
  114 6.35 64
  115 1.41 14
  119 1.17 12
  122 4.62 46
  123 5.23 52
  124 12.44 124
  125 3.16 32
  127 1.73 17
  137 3.24 32
  138 1.83 18
  148 1.74 17
  166 3.03 30
//