MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002910

METHYL 3-PENTENOATE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002910
RECORD_TITLE: METHYL 3-PENTENOATE; 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

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CH$NAME: METHYL 3-PENTENOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₀O₂
CH$EXACT_MASS: 114.06808
CH$SMILES: CC=CCC(=O)OC
CH$IUPAC: InChI=1S/C6H10O2/c1-3-4-5-6(7)8-2/h3-4H,5H2,1-2H3/b4-3+
CH$LINK: INCHIKEY KJALUUCEMMPKAC-ONEGZZNKSA-N

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AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0a4i-9000000000-6076dc2526ce421c1be9
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  15 31.11 311
  26 2.73 27
  27 24.93 249
  28 4.85 49
  29 35.68 357
  39 17.34 173
  41 4.41 44
  42 4.66 47
  43 6.56 66
  51 2.75 28
  53 9.96 100
  54 14.53 145
  55 99.99 999
  56 4.81 48
  59 37.93 379
  71 3.31 33
  72 12.47 125
  82 10.38 104
  83 8.54 85
  114 29.72 297
//