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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000209

PARA XYLENE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000209
RECORD_TITLE: PARA XYLENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: PARA XYLENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H10
CH$EXACT_MASS: 106.07825
CH$SMILES: Cc(c1)ccc(C)c1
CH$IUPAC: InChI=1S/C8H10/c1-7-3-5-8(2)6-4-7/h3-6H,1-2H3
CH$LINK: INCHIKEY URLKBWYHVLBVBO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2021868

AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-052f-9400000000-4b2097f841009fc7a1f9
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
  27 3.93 39
  38 1 10
  39 7.33 73
  41 1.31 13
  50 3.14 31
  51 9.75 98
  52 3.93 39
  53 2.29 23
  62 1.24 12
  63 3.53 35
  65 5.82 58
  77 11.91 119
  78 5.04 50
  79 8.84 88
  89 1.51 15
  91 99.99 999
  92 7.4 74
  102 1.11 11
  103 6.54 65
  104 2.16 22
  105 25.07 251
  106 50.39 504
  107 4.25 43
//

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