MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001210

1-ISOPROPYLALLYL ACETATE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001210
RECORD_TITLE: 1-ISOPROPYLALLYL 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$NAME: 1-ISOPROPYLALLYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₄O₂
CH$EXACT_MASS: 142.09938
CH$SMILES: C=CC(C(C)C)OC(C)=O
CH$IUPAC: InChI=1S/C8H14O2/c1-5-8(6(2)3)10-7(4)9/h5-6,8H,1H2,2-4H3
CH$LINK: INCHIKEY XAKHEXKHMNYRCG-UHFFFAOYSA-N

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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$SPLASH: splash10-0006-9000000000-edd73f5a91f38aa9c889
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  15 3 30
  18 1.5 15
  25 5.5 55
  26 0.4 4
  27 2.5 25
  29 1 10
  39 4 40
  41 0.9 9
  43 99.99 999
  44 1 10
  55 6 60
  56 0.1 1
  57 6 60
  58 2 20
  65 8 80
  66 0.2 2
  80 12 120
  81 1 10
  99 16 160
  100 1.35 14
  101 2 20
//