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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006021

2,3-DIMETHYLBUTANE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006021
RECORD_TITLE: 2,3-DIMETHYLBUTANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 2,3-DIMETHYLBUTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H14
CH$EXACT_MASS: 86.10955
CH$SMILES: CC(C)C(C)C
CH$IUPAC: InChI=1S/C6H14/c1-5(2)6(3)4/h5-6H,1-4H3
CH$LINK: INCHIKEY ZFFMLCVRJBZUDZ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9025112

AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-0006-9000000000-3c7a22f4ffc77da13848
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  15 1 10
  26 0.8 8
  27 13.1 131
  28 0.38 4
  29 6.2 62
  32 1 10
  38 0.8 8
  39 0.96 10
  40 1.7 17
  41 26.2 262
  42 94.2 942
  43 99.99 999
  44 3.3 33
  50 0.6 6
  51 0.9 9
  53 0.17 2
  55 4.8 48
  56 0.9 9
  57 1.1 11
  69 0.08 1
  70 1.1 11
  71 21.3 213
  72 1.4 14
  85 0.12 1
  86 8.1 81
  87 0.7 7
//

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