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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002116

METHOXY ACETIC ACID METHYL ESTER; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002116
RECORD_TITLE: METHOXY ACETIC ACID METHYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: METHOXY ACETIC ACID METHYL ESTER
CH$NAME: METHYL METHOXY ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H8O3
CH$EXACT_MASS: 104.04734
CH$SMILES: COCC(=O)OC
CH$IUPAC: InChI=1S/C4H8O3/c1-6-3-4(5)7-2/h3H2,1-2H3
CH$LINK: INCHIKEY QRMHDGWGLNLHMN-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3074608

AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-0002-9000000000-3df00b19857674681d71
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
  15 17.93 179
  28 1.06 11
  29 12.63 126
  31 2.44 24
  42 4.16 42
  43 4.81 48
  44 2.04 20
  45 99.99 999
  46 1.79 18
  59 3.26 33
  74 23.55 236
  75 5.05 51
//

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