ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001332
RECORD_TITLE: 1-UNDECANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: 1-UNDECANOL
CH$NAME: UNDECYL ALCOHOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₂₄O
CH$EXACT_MASS: 172.18272
CH$SMILES: CCCCCCCCCCCO
CH$IUPAC: InChI=1S/C11H24O/c1-2-3-4-5-6-7-8-9-10-11-12/h12H,2-11H2,1H3
CH$LINK: COMPTOX DTXSID0026915
CH$LINK: INCHIKEY KJIOQYGWTQBHNH-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:8184

AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-0a4l-9000000000-7e5203a4c36f0f292fbf
PK$NUM_PEAK: 41
PK$PEAK: m/z int. rel.int.
  18 2.37 24
  27 16.43 164
  28 4.95 50
  29 34.72 347
  31 16.86 169
  39 12.12 121
  40 2.58 26
  41 78.48 785
  42 31.64 316
  43 96.84 968
  44 5.74 57
  45 2.8 28
  53 4.23 42
  54 8.03 80
  55 99.99 999
  56 85.22 852
  57 60.98 610
  58 2.94 29
  67 10.33 103
  68 25.9 259
  69 80.2 802
  70 73.24 732
  71 18.58 186
  73 2.15 22
  81 3.66 37
  82 22.31 223
  83 56.6 566
  84 44.62 446
  85 9.76 98
  95 1.43 14
  96 6.38 64
  97 37.16 372
  98 19.01 190
  99 2.15 22
  110 1.51 15
  111 11.55 116
  112 5.88 59
  125 4.66 47
  126 12.7 127
  127 1.43 14
  154 1.51 15
//