ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008684
RECORD_TITLE: TRANS-2-NONENAL; 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$NAME: TRANS-2-NONENAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₆O
CH$EXACT_MASS: 140.12012
CH$SMILES: CCCCCCC=CC=O
CH$IUPAC: InChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h7-9H,2-6H2,1H3/b8-7+
CH$LINK: INCHIKEY BSAIUMLZVGUGKX-BQYQJAHWSA-N
CH$LINK: COMPTOX DTXSID0047086

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$SPLASH: splash10-054o-9000000000-17c8fee9e98238a754e9
PK$NUM_PEAK: 50
PK$PEAK: m/z int. rel.int.
  15 2.41 24
  26 3.72 37
  27 56.28 563
  28 6.35 64
  29 56.41 564
  30 1.18 12
  38 2.51 25
  39 57.17 572
  40 7.23 72
  41 99.99 999
  42 30.34 303
  43 88.19 882
  44 2.89 29
  50 1.78 18
  51 4.28 43
  52 2.32 23
  53 15.19 152
  54 15.76 158
  55 71.05 711
  56 27.21 272
  57 43.55 436
  58 5.97 60
  65 2.61 26
  66 2.66 27
  67 17.09 171
  68 11.11 111
  69 35.24 352
  70 65.18 652
  71 7.59 76
  72 8.11 81
  77 2.42 24
  79 5.65 57
  80 2.94 29
  81 15.96 160
  82 4.7 47
  83 43.94 439
  84 22.67 227
  85 2.66 27
  93 7.65 77
  94 4.17 42
  95 2.08 21
  96 18.35 184
  97 11.73 117
  98 10.38 104
  99 1.08 11
  107 2.65 27
  109 2.24 22
  111 4.59 46
  112 1.79 18
  122 3 30
//