ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007717
RECORD_TITLE: TETRADECYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KYOTO INSTITUTE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: TETRADECYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₃₂O₂
CH$EXACT_MASS: 256.24023
CH$SMILES: CCCCCCCCCCCCCCOC(C)=O
CH$IUPAC: InChI=1S/C16H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-16(2)17/h3-15H2,1-2H3
CH$LINK: INCHIKEY IOUUIFSIQMVYKP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID40862341

AC$INSTRUMENT: SHIMADZU QP-1000
AC$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$SPLASH: splash10-0006-9000000000-01fa49568188ba8a4488
PK$NUM_PEAK: 44
PK$PEAK: m/z int. rel.int.
  40 1.4 14
  41 36.6 366
  42 11.7 117
  43 99.99 999
  44 3.5 35
  53 1.6 16
  54 4.2 42
  55 3.06 31
  56 20 200
  57 23.1 231
  58 2 20
  61 2.15 22
  67 4.4 44
  68 7.1 71
  69 21.1 211
  70 1.49 15
  71 8.2 82
  73 2.1 21
  81 2 20
  82 0.85 9
  83 17.8 178
  84 8.2 82
  85 3.6 36
  96 0.31 3
  97 12.3 123
  98 4.9 49
  99 0.7 7
  101 0.03 0
  110 1.1 11
  111 5.2 52
  112 2.3 23
  116 0.11 1
  124 0.5 5
  125 2 20
  126 1.1 11
  138 0.03 0
  139 0.6 6
  140 0.6 6
  153 0.2 2
  154 0.02 0
  168 1 10
  169 0.1 1
  196 0.5 5
  197 0.1 1
//