ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009064
RECORD_TITLE: 2-BUTOXYETHYL BUTYRATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: 2-BUTOXYETHYL BUTYRATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₂₀O₃
CH$EXACT_MASS: 188.14124
CH$SMILES: CCCCOCCOC(=O)CCC
CH$IUPAC: InChI=1S/C10H20O3/c1-3-5-7-12-8-9-13-10(11)6-4-2/h3-9H2,1-2H3
CH$LINK: INCHIKEY JWIUNFHJMLAEPS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5066613

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-0a4l-9000000000-cbfe3567b914a69dfb7a
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
  15 1.96 20
  26 1.6 16
  27 25.88 259
  28 4.95 50
  29 33 330
  30 1.27 13
  31 2.59 26
  39 10.61 106
  40 1.2 12
  41 48.99 490
  42 10.87 109
  43 68.4 684
  44 13.93 139
  45 15.6 156
  55 7.81 78
  56 76.58 766
  57 99.99 999
  58 8 80
  60 1.77 18
  63 1.09 11
  69 1.1 11
  70 1.9 19
  71 83.68 837
  72 5.42 54
  73 4.47 45
  74 1.83 18
  85 34.79 348
  86 5.89 59
  87 13.18 132
  88 8.2 82
  89 10.58 106
  99 1.13 11
  100 13.25 133
  101 4.35 44
  102 1.07 11
  115 16.84 168
  116 9.6 96
  117 4.96 50
//