ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007041
RECORD_TITLE: 5-NONANONE; 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$NAME: 5-NONANONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₈O
CH$EXACT_MASS: 142.13577
CH$SMILES: CCCCC(=O)CCCC
CH$IUPAC: InChI=1S/C9H18O/c1-3-5-7-9(10)8-6-4-2/h3-8H2,1-2H3
CH$LINK: INCHIKEY WSGCRAOTEDLMFQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7022045

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$SPLASH: splash10-0a6r-9000000000-7c37e6cffccad22e7dd5
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  15 1.61 16
  26 1.98 20
  27 28.99 290
  28 7.53 75
  29 56.2 562
  30 1.15 12
  39 15.05 151
  40 1.03 10
  41 48.71 487
  42 7.08 71
  43 8.04 80
  53 2.36 24
  55 7.9 79
  56 2.35 24
  57 99.99 999
  58 67.13 671
  59 4.29 43
  71 5.57 56
  72 1.67 17
  85 65.82 658
  86 2.71 27
  100 5.59 56
  113 2.38 24
  142 6.26 63
  143 1.12 11
//