ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000845
RECORD_TITLE: DIISOBUTYLHYDRAZONE ISOBUTYRALDEHYDE; 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$NAME: DIISOBUTYLHYDRAZONE ISOBUTYRALDEHYDE
CH$NAME: ISOBUTYRALDEHYDE DIISOBUTYLHYDRAZONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₂₆N₂
CH$EXACT_MASS: 198.20960
CH$SMILES: CCCC=NN(CC(C)C)CC(C)C
CH$IUPAC: InChI=1S/C12H26N2/c1-6-7-8-13-14(9-11(2)3)10-12(4)5/h8,11-12H,6-7,9-10H2,1-5H3/b13-8+
CH$LINK: INCHIKEY ASPGBKIEGSGRKE-MDWZMJQESA-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$SPLASH: splash10-0a4i-9800000000-a686e7e6d1b74d5e10ab
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
  27 4.4 44
  28 2.4 24
  29 12.4 124
  30 1.1 11
  39 3 30
  40 0.6 6
  41 14.8 148
  42 0.84 8
  43 12.9 129
  44 1.4 14
  53 0.5 5
  54 0.05 1
  55 3.7 37
  56 2.5 25
  57 18.6 186
  58 0.17 2
  68 0.8 8
  69 0.8 8
  70 7.1 71
  71 0.07 1
  72 1.9 19
  82 0.7 7
  83 0.6 6
  84 0.22 2
  86 2 20
  97 0.7 7
  99 42.2 422
  100 0.27 3
  111 0.7 7
  113 1.6 16
  127 0.5 5
  141 0.05 1
  155 99.99 999
  156 11 110
  183 1.2 12
  197 0.05 1
  198 10.8 108
  199 1.8 18
//