ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008104
RECORD_TITLE: 14-METHYL-1-PENTADECANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 14-METHYL-1-PENTADECANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₃₄O
CH$EXACT_MASS: 242.26097
CH$SMILES: OCCCCCCCCCCCCCC(C)C
CH$IUPAC: InChI=1S/C16H34O/c1-16(2)14-12-10-8-6-4-3-5-7-9-11-13-15-17/h16-17H,3-15H2,1-2H3
CH$LINK: INCHIKEY CFSSWEQYBLCBLH-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID20892060

AC$INSTRUMENT: JEOL JMS-HX-100
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 40 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0a4i-9100000000-7092f40888a3adb2a594
PK$NUM_PEAK: 59
PK$PEAK: m/z int. rel.int.
  15 0.76 8
  31 5.08 51
  39 2.56 26
  40 0.45 5
  41 29.34 293
  42 9.97 100
  43 68.77 688
  45 1.5 15
  47 0.61 6
  54 7.18 72
  55 67.11 671
  56 99.99 999
  57 94.74 947
  58 4.51 45
  67 9.68 97
  68 28.87 289
  69 88.33 883
  70 43.43 434
  71 29.41 294
  72 1.9 19
  73 1.5 15
  75 0.62 6
  81 6.03 60
  82 27.66 277
  83 62.36 624
  84 26.47 265
  85 7.27 73
  87 0.19 2
  95 3.41 34
  96 8.75 88
  97 51.57 516
  98 14.56 146
  99 4.34 43
  109 1.31 13
  110 4.22 42
  111 31 310
  112 11.25 113
  113 3 30
  123 2.01 20
  124 2.91 29
  125 13.2 132
  126 6.85 69
  127 1.76 18
  129 0.18 2
  137 2.05 21
  138 2.02 20
  139 5.43 54
  140 7.37 74
  141 1.54 15
  149 0.34 3
  153 2.7 27
  154 2.41 24
  168 10.84 108
  169 1.83 18
  181 2.91 29
  182 1.82 18
  196 11.35 114
  197 2.36 24
  224 4.61 46
//