MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001204

ISOPENTYL ACETATE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001204
RECORD_TITLE: ISOPENTYL 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$NAME: ISOPENTYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₁₄O₂
CH$EXACT_MASS: 130.09938
CH$SMILES: CC(C)CCOC(C)=O
CH$IUPAC: InChI=1S/C7H14O2/c1-6(2)4-5-9-7(3)8/h6H,4-5H2,1-3H3
CH$LINK: INCHIKEY MLFHJEHSLIIPHL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9025453

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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 70 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-00kf-9000000000-b39e66ca9f24f516c159
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  15 4.5 45
  19 10 100
  24 6.5 65
  25 5.15 52
  43 99.99 999
  55 32.5 325
  56 2.5 25
  57 0.2 2
  58 1 10
  59 1 10
  61 8.5 85
  65 0.25 3
  67 51.5 515
  69 2.5 25
  70 8.5 85
  73 0.2 2
  86 3 30
  87 20.5 205
  89 3 30
  100 0.2 2
  113 2 20
  126 2 20
//