ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010779
RECORD_TITLE: ETHYL LAURATE; 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$NAME: ETHYL LAURATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₂₈O₂
CH$EXACT_MASS: 228.20893
CH$SMILES: CCCCCCCCCCCC(=O)OCC
CH$IUPAC: InChI=1S/C14H28O2/c1-3-5-6-7-8-9-10-11-12-13-14(15)16-4-2/h3-13H2,1-2H3
CH$LINK: INCHIKEY MMXKVMNBHPAILY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4047044

AC$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-000i-9300000000-53980699cddfb543d2db
PK$NUM_PEAK: 39
PK$PEAK: m/z int. rel.int.
  29 1.7 17
  43 3.7 37
  45 2.7 27
  55 0.17 2
  57 5 50
  60 5.3 53
  61 8.3 83
  69 0.23 2
  70 8.6 86
  71 2.3 23
  73 8.6 86
  74 0.13 1
  83 2 20
  84 2.3 23
  85 2 20
  87 0.17 2
  88 99.99 999
  89 13.3 133
  90 1 10
  95 0.1 1
  97 2 20
  98 2 20
  101 35.5 355
  102 0.37 4
  111 1 10
  115 4.7 47
  129 3 30
  130 0.1 1
  143 5 50
  144 1 10
  157 9 90
  158 0.13 1
  171 2 20
  183 8.6 86
  184 1.3 13
  185 0.66 7
  199 2.7 27
  228 15.9 159
  229 2.7 27
//