MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012247

META-XYLENE; CI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012247
RECORD_TITLE: META-XYLENE; 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$NAME: META-XYLENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₀
CH$EXACT_MASS: 106.07825
CH$SMILES: Cc(c1)cc(C)cc1
CH$IUPAC: InChI=1S/C8H10/c1-7-4-3-5-8(2)6-7/h3-6H,1-2H3
CH$LINK: CAS 108-38-3
CH$LINK: INCHIKEY IVSZLXZYQVIEFR-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6026298

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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$SPLASH: splash10-0a4i-0900000000-2370bbe07a9d5e20584f
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  105 11.93 119
  106 7.82 78
  107 99.99 999
  108 8.8 88
  135 20.4 204
  136 2.14 21
  147 6.73 67
//