ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007703
RECORD_TITLE: 1-NONANOL; 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$NAME: 1-NONANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₂₀O
CH$EXACT_MASS: 144.15142
CH$SMILES: CCCCCCCCCO
CH$IUPAC: InChI=1S/C9H20O/c1-2-3-4-5-6-7-8-9-10/h10H,2-9H2,1H3
CH$LINK: CAS 143-08-8
CH$LINK: INCHIKEY ZWRUINPWMLAQRD-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6022008

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$SPLASH: splash10-052f-9000000000-7317cd2db1aad9ad8ee0
PK$NUM_PEAK: 37
PK$PEAK: m/z int. rel.int.
  40 5.1 51
  41 99.99 999
  42 45.6 456
  43 8.87 89
  44 8.1 81
  45 13.3 133
  51 1 10
  53 0.4 4
  54 5.7 57
  55 68.3 683
  56 75.1 751
  57 2.65 27
  58 2.3 23
  59 1.5 15
  65 0.4 4
  67 0.45 5
  68 12.1 121
  69 35 350
  70 38.3 383
  71 0.68 7
  73 3.6 36
  79 0.5 5
  81 0.9 9
  82 0.47 5
  83 14.8 148
  84 10.3 103
  85 1.8 18
  87 0.07 1
  89 0.9 9
  96 1 10
  97 9 90
  98 0.91 9
  99 0.7 7
  103 0.3 3
  105 0.5 5
  111 0.04 0
  126 0.3 3
//