ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008228
RECORD_TITLE: METHYL 3-PENTENOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UBE SCIENTIFIC ANALYSIS LABORATORY
LICENSE: CC BY-NC-SA

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$LINK: CAS 818-58-6
CH$LINK: INCHIKEY KJALUUCEMMPKAC-ONEGZZNKSA-N

AC$INSTRUMENT: HITACHI M-60
AC$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$SPLASH: splash10-0a4i-9000000000-e69b78d23732260dfa38
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  15 31.11 311
  16 1.4 14
  26 2.73 27
  27 24.93 249
  28 4.85 49
  29 35.68 357
  39 17.34 173
  40 1.88 19
  41 4.41 44
  42 4.66 47
  43 6.56 66
  50 1.74 17
  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
  74 1.66 17
  81 1.1 11
  82 10.38 104
  83 8.54 85
  99 1.41 14
  114 29.72 297
  115 1.97 20
//