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MassBank Record: JP002346

ETHYL ACETATE; EI-B; MS

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

ACCESSION: JP002346
RECORD_TITLE: ETHYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: ETHYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H8O2
CH$EXACT_MASS: 88.05243
CH$SMILES: CCOC(C)=O
CH$IUPAC: InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3
CH$LINK: INCHIKEY XEKOWRVHYACXOJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1022001

AC$INSTRUMENT: JEOL JMS-D-3000
AC$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$SPLASH: splash10-0006-9000000000-4950ee9233400dc5bfe6
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  42 5.15 52
  43 99.99 999
  44 1.36 14
  45 15.2 152
  60 1.04 10
  61 15.29 153
  70 10.09 101
  73 4.47 45
  88 5.39 54
//

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