ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007018
RECORD_TITLE: 3-DECANOL; 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$NAME: 3-DECANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H22O
CH$EXACT_MASS: 158.16707
CH$SMILES: CCCCCCCC(O)CC
CH$IUPAC: InChI=1S/C10H22O/c1-3-5-6-7-8-9-10(11)4-2/h10-11H,3-9H2,1-2H3
CH$LINK: INCHIKEY ICEQLCZWZXUUIJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID50862695
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$SPLASH: splash10-0a4i-9000000000-3b5fbb368c5a3ae8d657
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  27 11.57 116
  29 16.88 169
  31 16.07 161
  39 4.9 49
  41 30.43 304
  42 4.9 49
  43 18.26 183
  44 2.79 28
  45 1.42 14
  53 1.34 13
  54 1.02 10
  55 33.17 332
  56 5.19 52
  57 15.39 154
  58 10.49 105
  59 99.99 999
  60 2.75 28
  67 1.48 15
  69 71.19 712
  70 5.23 52
  71 1.56 16
  72 1.22 12
  83 5.21 52
  84 1.86 19
  85 1.26 13
  97 1.41 14
  98 1.1 11
  111 15.88 159
  112 1.9 19
  129 19.07 191
  130 1.6 16
  140 2.01 20
//
