ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000739
RECORD_TITLE: 3,3,7-TRIMETHYL-4-OXA-7-OCTEN-1-OL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NAKAYAMA M, MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 3,3,7-TRIMETHYL-4-OXA-7-OCTEN-1-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₂₀O₂
CH$EXACT_MASS: 172.14633
CH$SMILES: OCCC(C)(C)OCCC(C)=C
CH$IUPAC: InChI=1S/C10H20O2/c1-9(2)5-8-12-10(3,4)6-7-11/h11H,1,5-8H2,2-4H3
CH$LINK: INCHIKEY OYSGDRSBCITWNM-UHFFFAOYSA-N

AC$INSTRUMENT: HITACHI RMS-4
AC$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$SPLASH: splash10-014i-9000000000-4086e06943bfb6ed2a05
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
  31 41 410
  39 5 50
  40 2 20
  41 30 300
  42 3 30
  43 10 100
  44 1 10
  45 4 40
  53 3 30
  54 1 10
  55 7 70
  56 6 60
  57 7 70
  58 1 10
  59 6 60
  60 1 10
  67 4 40
  68 6 60
  69 99.99 999
  70 11 110
  71 10 100
  81 4 40
  87 22 220
  88 1 10
  89 5 50
  97 1 10
  99 16 160
  100 1 10
  103 3 30
  105 3 30
  115 3 30
  116 1 10
  117 5 50
  127 5 50
  138 1 10
  139 1 10
  143 1 10
  147 1 10
  155 3 30
  156 1 10
  157 1 10
  172 2 20
//