ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000870
RECORD_TITLE: DIMETHYLHYDRAZONE BETA-METHYLACRYLALDEHYDE; 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$NAME: DIMETHYLHYDRAZONE BETA-METHYLACRYLALDEHYDE
CH$NAME: 2-BUTENAL DIMETHYLHYDRAZONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₂N₂
CH$EXACT_MASS: 112.10005
CH$SMILES: CC=CC=NN(C)C
CH$IUPAC: InChI=1S/C6H12N2/c1-4-5-6-7-8(2)3/h4-6H,1-3H3/b5-4+,7-6+
CH$LINK: INCHIKEY KVKJBRFOURXWON-YTXTXJHMSA-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$SPLASH: splash10-0296-9100000000-1e311aa008df93b3b319
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
  28 47.7 477
  29 8.7 87
  30 21.3 213
  37 0.21 2
  38 5.2 52
  39 34.8 348
  40 6.1 61
  41 5.11 51
  42 78.1 781
  43 47.7 477
  44 74 740
  45 2.83 28
  46 11.7 117
  50 1.9 19
  51 3.9 39
  52 0.27 3
  53 14.8 148
  54 9.6 96
  55 6.5 65
  56 4.35 44
  57 10 100
  58 7.8 78
  59 7.4 74
  67 2.35 24
  68 69.5 695
  69 31.3 313
  70 36.1 361
  71 0.48 5
  80 4.3 43
  81 4.6 46
  82 13 130
  83 0.76 8
  84 9.3 93
  85 1.2 12
  94 1.7 17
  95 0.41 4
  96 4.3 43
  97 30 300
  98 2 20
  111 0.65 7
  112 99.99 999
  113 10 100
//