MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012274

1,3-DIETHYLBENZENE; CI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012274
RECORD_TITLE: 1,3-DIETHYLBENZENE; 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

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CH$NAME: 1,3-DIETHYLBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₄
CH$EXACT_MASS: 134.10955
CH$SMILES: CCc(c1)cc(CC)cc1
CH$IUPAC: InChI=1S/C10H14/c1-3-9-6-5-7-10(4-2)8-9/h5-8H,3-4H2,1-2H3
CH$LINK: CAS 141-93-5
CH$LINK: INCHIKEY AFZZYIJIWUTJFO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1022003

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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

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PK$SPLASH: splash10-000i-0900000000-dde864af84b2e1f7af54
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  107 3.57 36
  119 7.69 77
  133 15.2 152
  134 7.26 73
  135 99.99 999
  136 10.98 110
  163 19.6 196
  164 2.56 26
  175 6.01 60
//