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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012302

2-PHENYLDECANE; CI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012302
RECORD_TITLE: 2-PHENYLDECANE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: IIDA Y, DAISHIMA S, FAC. OF ENGINEERING, SEIKEI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 2-PHENYLDECANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H26
CH$EXACT_MASS: 218.20345
CH$SMILES: CCCCCCCCC(C)c(c1)cccc1
CH$IUPAC: InChI=1S/C16H26/c1-3-4-5-6-7-9-12-15(2)16-13-10-8-11-14-16/h8,10-11,13-15H,3-7,9,12H2,1-2H3
CH$LINK: CAS 4537-13-7
CH$LINK: INCHIKEY DDTJIQUCOLHYDL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID10874870

AC$INSTRUMENT: FINNIGAN-MAT 4500
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 120 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE

PK$SPLASH: splash10-00kf-1940000000-12079a1bfcb9831e7089
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  57 3.43 34
  71 6.46 65
  79 1.2 12
  85 7.54 75
  99 4.22 42
  105 21.26 213
  106 2.14 21
  107 2.53 25
  119 5.06 51
  133 1.78 18
  141 99.99 999
  142 10.68 107
  147 2.29 23
  161 2.65 27
  203 9.77 98
  204 1.6 16
  217 46.29 463
  218 14.9 149
  219 3.9 39
//

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