ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000822
RECORD_TITLE: ISOPROPYLHYDRAZONE ACETONE; 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$NAME: ISOPROPYLHYDRAZONE ACETONE
CH$NAME: ACETONE ISOPROPYLHYDRAZONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄N₂
CH$EXACT_MASS: 114.11570
CH$SMILES: CC(C)NN=C(C)C
CH$IUPAC: InChI=1S/C6H14N2/c1-5(2)7-8-6(3)4/h5,7H,1-4H3
CH$LINK: INCHIKEY NEMJPYNJMBONJU-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID50225226

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$SPLASH: splash10-0a4j-9000000000-351807f0bc5477cf4896
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  27 11.4 114
  28 16.9 169
  29 6.9 69
  30 1.29 13
  31 2.9 29
  32 2.9 29
  39 9.7 97
  40 0.34 3
  41 19.7 197
  42 21.7 217
  43 12 120
  44 0.94 9
  54 3.7 37
  55 6.9 69
  56 99.99 999
  57 1.74 17
  58 11.1 111
  71 5.7 57
  72 4.6 46
  82 0.1 1
  83 0.9 9
  99 88.6 886
  100 0.7 7
  113 0.18 2
  114 31.5 315
  115 3.1 31
//