ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010006
RECORD_TITLE: 3-METHYL-1,5-PENTANEDIAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 3-METHYL-1,5-PENTANEDIAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H16N2
CH$EXACT_MASS: 116.13135
CH$SMILES: NCCC(C)CCN
CH$IUPAC: InChI=1S/C6H16N2/c1-6(2-4-7)3-5-8/h6H,2-5,7-8H2,1H3
CH$LINK: INCHIKEY FJSUFIIJYXMJQO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID20563642
AC$INSTRUMENT: JEOL JMS-D-300
AC$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$SPLASH: splash10-001i-9000000000-0d97800d493b220b5dec
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  27 6.1 61
  28 3.6 36
  29 4.7 47
  30 99.99 999
  31 5.2 52
  39 4.7 47
  41 9.5 95
  42 1.03 10
  43 15.5 155
  44 8.7 87
  45 12.1 121
  55 1.36 14
  56 38.1 381
  57 4.2 42
  67 3.5 35
  70 3.08 31
  71 2.3 23
  72 2.3 23
  73 5.3 53
  82 0.24 2
  84 4.4 44
  86 3.7 37
  87 3.4 34
  97 0.31 3
  98 2.5 25
  99 7.9 79
  100 3 30
//
