ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002624
RECORD_TITLE: BETA-ETHOXYPROPIONIC ACID METHYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: BETA-ETHOXYPROPIONIC ACID METHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₂O₃
CH$EXACT_MASS: 132.07864
CH$SMILES: CCOCCC(=O)OC
CH$IUPAC: InChI=1S/C6H12O3/c1-3-9-5-4-6(7)8-2/h3-5H2,1-2H3
CH$LINK: COMPTOX DTXSID60564916
CH$LINK: INCHIKEY HSDFKDZBJMDHFF-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:14876011

AC$INSTRUMENT: JEOL JMS-01-SG
AC$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$SPLASH: splash10-0a4r-9100000000-fd8680b050ecc7bd79ee
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  41 9.9 99
  42 12.7 127
  44 30.5 305
  55 2.26 23
  56 5.4 54
  57 26.8 268
  58 4.4 44
  59 99.99 999
  60 10.9 109
  61 21.6 216
  71 57.7 577
  72 2.09 21
  87 30.5 305
  88 67.3 673
  89 4.1 41
  101 3.57 36
  103 54.9 549
  104 3.7 37
//