ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008105
RECORD_TITLE: 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$NAME: 1-PENTADECANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₃₂O
CH$EXACT_MASS: 228.24532
CH$SMILES: CCCCCCCCCCCCCCCO
CH$IUPAC: InChI=1S/C15H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h16H,2-15H2,1H3
CH$LINK: INCHIKEY REIUXOLGHVXAEO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0027270

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$SPLASH: splash10-0a59-9100000000-24988e5c47c70540f957
PK$NUM_PEAK: 61
PK$PEAK: m/z int. rel.int.
  14 0.44 4
  27 4.44 44
  29 14.16 142
  31 6.91 69
  35 0.04 0
  39 3.41 34
  41 46.42 464
  42 15.67 157
  43 83.88 839
  45 1.71 17
  48 0.33 3
  53 2.25 23
  54 8.78 88
  55 98.63 986
  56 63.15 632
  57 86.17 862
  58 4.12 41
  60 0.01 0
  67 15.91 159
  68 41.26 413
  69 99.99 999
  70 75.55 756
  71 39.31 393
  72 2.37 24
  73 1.37 14
  79 1.75 18
  81 9.03 90
  82 47.04 470
  83 90.97 910
  84 50.77 508
  85 7.95 80
  86 2.05 21
  95 4.12 41
  96 14.71 147
  97 84.67 847
  98 31.26 313
  99 6.67 67
  109 2.4 24
  110 9.13 91
  111 46.03 460
  112 21.71 217
  113 3.61 36
  123 1.77 18
  124 5.42 54
  125 22.1 221
  126 14.12 141
  127 2.07 21
  138 3.37 34
  139 6.89 69
  140 9.45 95
  141 2.19 22
  152 2.12 21
  153 4.1 41
  154 6.77 68
  167 1.83 18
  168 2.81 28
  182 13.75 138
  183 2.62 26
  207 0.68 7
  208 0.72 7
  210 5.89 59
//