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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000836

DIMETHYLHYDRAZONE VALERALDEHYDE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000836
RECORD_TITLE: DIMETHYLHYDRAZONE VALERALDEHYDE; 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$NAME: DIMETHYLHYDRAZONE VALERALDEHYDE
CH$NAME: PENTANAL DIMETHYLHYDRAZONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H16N2
CH$EXACT_MASS: 128.13135
CH$SMILES: CCCCC=NN(C)C
CH$IUPAC: InChI=1S/C7H16N2/c1-4-5-6-7-8-9(2)3/h7H,4-6H2,1-3H3/b8-7-
CH$LINK: INCHIKEY GETAETQIBNJCHL-FPLPWBNLSA-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$SPLASH: splash10-0006-9000000000-0f0ce54b2c4984a4d6df
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  27 19.4 194
  29 12.5 125
  30 10 100
  39 0.76 8
  41 17.5 175
  42 46.2 462
  43 48.8 488
  44 99.99 999
  45 36.2 362
  46 4.1 41
  55 5.5 55
  56 0.75 8
  57 5.5 55
  58 8.8 88
  70 2.8 28
  71 1.56 16
  72 3.2 32
  83 2.4 24
  84 3.1 31
  85 8.11 81
  86 83.9 839
  87 4.8 48
  99 17.5 175
  100 0.3 3
  113 11.3 113
  114 1 10
  127 2.2 22
  128 6.61 66
  129 6.1 61
//

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