ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012133
RECORD_TITLE: 2,2-DIMETHYLBUTANE; 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$NAME: 2,2-DIMETHYLBUTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄
CH$EXACT_MASS: 86.10955
CH$SMILES: CCC(C)(C)C
CH$IUPAC: InChI=1S/C6H14/c1-5-6(2,3)4/h5H2,1-4H3
CH$LINK: CAS 75-83-2
CH$LINK: INCHIKEY HNRMPXKDFBEGFZ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4025111

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$SPLASH: splash10-00dr-9000000000-555a2193a18060d76185
PK$NUM_PEAK: 6
PK$PEAK: m/z int. rel.int.
  56 6.67 67
  57 19.6 196
  71 99.99 999
  72 6.96 70
  85 78.66 787
  86 6.28 63
//