ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009227
RECORD_TITLE: TRANS-2-HEXENYL LACTATE; 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$NAME: TRANS-2-HEXENYL LACTATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₆O₃
CH$EXACT_MASS: 172.10994
CH$SMILES: CCCC=CCOC(=O)C(C)O
CH$IUPAC: InChI=1S/C9H16O3/c1-3-4-5-6-7-12-9(11)8(2)10/h5-6,8,10H,3-4,7H2,1-2H3/b6-5+
CH$LINK: INCHIKEY CLRYHPFNHRAPPN-AATRIKPKSA-N

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$SPLASH: splash10-052b-9000000000-a889e0d37486c46bd9f3
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
  15 2.8 28
  18 1.4 14
  19 2.2 22
  26 0.17 2
  27 19.2 192
  29 14.7 147
  31 1 10
  38 0.11 1
  39 18.2 182
  41 45.1 451
  42 4.1 41
  43 1.35 14
  44 6.4 64
  45 99.99 999
  46 1.9 19
  50 0.13 1
  51 2.1 21
  52 1.2 12
  53 6.6 66
  54 0.94 9
  55 48.5 485
  56 6.8 68
  57 10 100
  65 0.18 2
  67 20.3 203
  68 1.2 12
  71 1.5 15
  81 0.26 3
  82 8.5 85
  83 32.2 322
  84 2.8 28
  99 0.12 1
  100 1 10
//