ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000867
RECORD_TITLE: METHYLALLYLHYDRAZONE METHYLETHYLKETONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: METHYLALLYLHYDRAZONE METHYLETHYLKETONE
CH$NAME: 2-BUTANONE ALLYLMETHYLHYDRAZONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₆N₂
CH$EXACT_MASS: 140.13135
CH$SMILES: C=CCN(C)N=C(C)CC
CH$IUPAC: InChI=1S/C8H16N2/c1-5-7-10(4)9-8(3)6-2/h5H,1,6-7H2,2-4H3/b9-8-
CH$LINK: INCHIKEY CQUSZUHIHJRXMG-HJWRWDBZSA-N

AC$INSTRUMENT: SHIMADZU LKB-2091
AC$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$SPLASH: splash10-0006-9000000000-234bde46d2f74e4c22ae
PK$NUM_PEAK: 41
PK$PEAK: m/z int. rel.int.
  26 2 20
  27 15 150
  28 12.4 124
  29 1.67 17
  30 19 190
  31 0.8 8
  32 2.9 29
  39 1.57 16
  40 2.9 29
  41 34.8 348
  42 99.99 999
  43 4.29 43
  44 19.3 193
  45 1.9 19
  53 2.3 23
  54 0.33 3
  55 30 300
  56 12.9 129
  57 2.7 27
  58 2.29 23
  59 1.2 12
  68 15.7 157
  69 5.2 52
  70 3.39 34
  71 10.5 105
  72 3.6 36
  82 1.6 16
  83 0.22 2
  84 2 20
  97 12.9 129
  98 2.1 21
  99 6.2 62
  100 4.3 43
  111 3.6 36
  112 1.6 16
  113 3.39 34
  114 2.4 24
  125 3.3 33
  139 2.2 22
  140 4.29 43
  141 5.2 52
//