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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000834

ETHYLISOPROPYLHYDRAZONE ACETALDEHYDE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000834
RECORD_TITLE: ETHYLISOPROPYLHYDRAZONE ACETALDEHYDE; 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$NAME: ETHYLISOPROPYLHYDRAZONE ACETALDEHYDE
CH$NAME: ACETALDEHYDE ETHYLISOPROPYLHYDRAZONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H16N2
CH$EXACT_MASS: 128.13135
CH$SMILES: CC=NN(CC)C(C)C
CH$IUPAC: InChI=1S/C7H16N2/c1-5-8-9(6-2)7(3)4/h5,7H,6H2,1-4H3/b8-5+
CH$LINK: INCHIKEY KBQAGUKZIMHXKW-VMPITWQZSA-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$SPLASH: splash10-03fu-9400000000-867c772cc2a47ff3416c
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  27 15.8 158
  28 15.8 158
  29 28.5 285
  30 1.16 12
  39 4.9 49
  40 1.8 18
  41 13.3 133
  42 4.25 43
  43 17 170
  44 27.9 279
  45 1.1 11
  54 0.11 1
  55 1.9 19
  56 14.6 146
  57 6.9 69
  58 0.38 4
  68 1.7 17
  69 2.1 21
  70 19.4 194
  71 4.49 45
  72 4.8 48
  84 15.8 158
  85 12.1 121
  86 0.12 1
  113 99.99 999
  114 8.4 84
  127 1 10
  128 3.27 33
  129 4.1 41
//

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