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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009328

DECYLALDEHYDE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009328
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 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-05mo-9100000000-d33aea8d64934a73baad
PK$NUM_PEAK: 55
PK$PEAK: m/z int. rel.int.
  27 1.3 13
  28 1.2 12
  29 13.3 133
  30 0.12 1
  31 1.3 13
  41 28.6 286
  42 29.3 293
  43 99.99 999
  44 86.8 868
  45 32.5 325
  46 1 10
  53 0.1 1
  54 20.4 204
  55 62.2 622
  56 76.1 761
  57 9.21 92
  58 10.7 107
  59 2.2 22
  60 3.1 31
  66 1.12 11
  67 44.8 448
  68 75.4 754
  69 51.5 515
  70 8.93 89
  71 58.5 585
  72 18.1 181
  73 2.5 25
  79 0.14 1
  80 1.8 18
  81 42.1 421
  82 84.8 848
  83 6.05 61
  84 41.4 414
  85 11 110
  86 3.6 36
  94 0.32 3
  95 33.8 338
  96 37.4 374
  97 13.9 139
  98 0.27 3
  99 6.1 61
  100 3.6 36
  109 18.5 185
  110 3.14 31
  111 4.6 46
  112 58.8 588
  113 8.8 88
  114 0.12 1
  123 1.9 19
  127 1.5 15
  128 12.8 128
  129 0.17 2
  138 9.7 97
  139 1.5 15
  156 1.2 12
//

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