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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000889

5-METHYL-2-PYRAZOLINE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000889
RECORD_TITLE: 5-METHYL-2-PYRAZOLINE; 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$NAME: 5-METHYL-2-PYRAZOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H8N2
CH$EXACT_MASS: 84.06875
CH$SMILES: CC(C1)NN=C1
CH$IUPAC: InChI=1S/C4H8N2/c1-4-2-3-5-6-4/h3-4,6H,2H2,1H3
CH$LINK: INCHIKEY KDTSAMBCRXSULF-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID70338544

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$SPLASH: splash10-014l-9000000000-294c5107dcb60f35fe1d
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  26 4.3 43
  27 15.7 157
  28 21.5 215
  29 0.91 9
  30 2.5 25
  38 1.7 17
  39 8.6 86
  40 0.43 4
  41 11 110
  42 76.1 761
  43 8.6 86
  44 0.21 2
  50 1.3 13
  51 1.5 15
  52 1.1 11
  53 0.23 2
  54 1.6 16
  55 2.8 28
  56 6.7 67
  68 0.14 1
  69 99.99 999
  70 4.8 48
  83 7.2 72
  84 4.76 48
  85 5.2 52
//

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