MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012266

TERT-BUTYLBENZENE; CI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012266
RECORD_TITLE: TERT-BUTYLBENZENE; 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$NAME: TERT-BUTYLBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₄
CH$EXACT_MASS: 134.10955
CH$SMILES: CC(C)(C)c(c1)cccc1
CH$IUPAC: InChI=1S/C10H14/c1-10(2,3)9-7-5-4-6-8-9/h4-8H,1-3H3
CH$LINK: CAS 98-06-6
CH$LINK: INCHIKEY YTZKOQUCBOVLHL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3047138

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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$SPLASH: splash10-0a4i-9200000000-f9f01b2377ddbb521dfe
PK$NUM_PEAK: 6
PK$PEAK: m/z int. rel.int.
  57 99.99 999
  58 6.52 65
  119 17.24 172
  120 1.75 18
  133 5.32 53
  134 2.87 29
//