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MassBank Record: JP009121

TETRACOSANE; EI-B; MS

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

ACCESSION: JP009121
RECORD_TITLE: TETRACOSANE; 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$NAME: TETRACOSANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C24H50
CH$EXACT_MASS: 338.39125
CH$SMILES: CCCCCCCCCCCCCCCCCCCCCCCC
CH$IUPAC: InChI=1S/C24H50/c1-3-5-7-9-11-13-15-17-19-21-23-24-22-20-18-16-14-12-10-8-6-4-2/h3-24H2,1-2H3
CH$LINK: CAS 646-31-1
CH$LINK: INCHIKEY POOSGDOYLQNASK-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8060955

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$SPLASH: splash10-0a4l-9000000000-eb1df71fee79807844a1
PK$NUM_PEAK: 39
PK$PEAK: m/z int. rel.int.
  27 3.88 39
  29 12.19 122
  39 3.24 32
  41 32.79 328
  42 11.69 117
  43 78.75 788
  44 2.94 29
  53 1.29 13
  54 2.63 26
  55 26.48 265
  56 11.91 119
  57 99.99 999
  58 2.35 24
  67 1.3 13
  68 2 20
  69 12.46 125
  70 14.72 147
  71 52.24 522
  72 1.3 13
  82 1.31 13
  83 7.02 70
  84 3.21 32
  85 34.7 347
  86 1.29 13
  96 1.13 11
  97 4.87 49
  98 2.07 21
  99 10.48 105
  111 1.56 16
  112 2.15 22
  113 3.31 33
  126 1.13 11
  127 3.11 31
  140 1.2 12
  154 1.02 10
  155 1.74 17
  182 1.17 12
  183 1.58 16
  197 1.21 12
//

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