MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001207

2,2-DIMETHYLPROPYL ACETATE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001207
RECORD_TITLE: 2,2-DIMETHYLPROPYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

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CH$NAME: 2,2-DIMETHYLPROPYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₁₄O₂
CH$EXACT_MASS: 130.09938
CH$SMILES: CC(=O)OCC(C)(C)C
CH$IUPAC: InChI=1S/C7H14O2/c1-6(8)9-5-7(2,3)4/h5H2,1-4H3
CH$LINK: INCHIKEY QLNYTCSELYEEPV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID40239059

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AC$INSTRUMENT: HITACHI RMU-6D
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0a4l-9000000000-1be30c42fa9a2f59a9ed
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
  17 3.5 35
  25 18.5 185
  26 2.5 25
  28 0.35 4
  41 6 60
  42 2 20
  43 75 750
  45 0.25 3
  54 11.5 115
  55 30 300
  57 99.99 999
  59 0.4 4
  67 8.5 85
  68 2 20
  70 8.5 85
  71 0.8 8
  72 52 520
  74 2 20
  88 2 20
  100 0.2 2
  114 8 80
  115 2 20
  133 2 20
//