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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001485

DECYLALDEHYDE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001485
RECORD_TITLE: DECYLALDEHYDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: DECYLALDEHYDE
CH$NAME: DECANAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H20O
CH$EXACT_MASS: 156.15142
CH$SMILES: CCCCCCCCCC=O
CH$IUPAC: InChI=1S/C10H20O/c1-2-3-4-5-6-7-8-9-10-11/h10H,2-9H2,1H3
CH$LINK: INCHIKEY KSMVZQYAVGTKIV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4021553

AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-052f-9000000000-7749bc046eaf4c263d51
PK$NUM_PEAK: 52
PK$PEAK: m/z int. rel.int.
  15 2.8 28
  26 1.97 20
  27 45.73 457
  28 9.74 97
  29 64.07 641
  30 2.18 22
  31 3.03 30
  39 27.08 271
  40 4.92 49
  41 99.99 999
  42 33.85 339
  43 97.86 979
  44 54.46 545
  45 17.91 179
  51 1.47 15
  53 7.21 72
  54 15.49 155
  55 62.98 630
  56 40.49 405
  57 49.25 493
  58 5.24 52
  59 1.3 13
  65 1.21 12
  66 4.97 50
  67 25.59 256
  68 34.4 344
  69 29.14 291
  70 41.81 418
  71 26.32 263
  72 7.38 74
  79 1.88 19
  80 1.39 14
  81 22.03 220
  82 34.5 345
  83 25.61 256
  84 15.79 158
  85 3.97 40
  86 1.52 15
  94 1.09 11
  95 16.35 164
  96 16.17 162
  97 5.44 54
  98 1.09 11
  99 2.56 26
  100 1.27 13
  109 7.74 77
  110 13.56 136
  111 1.79 18
  112 24.29 243
  113 3.06 31
  128 4.97 50
  138 4.77 48
//

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