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MassBank Record: JP002883

1,12-DIAMINO-DODECANE; EI-B; MS

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

ACCESSION: JP002883
RECORD_TITLE: 1,12-DIAMINO-DODECANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 1,12-DIAMINO-DODECANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H28N2
CH$EXACT_MASS: 200.22525
CH$SMILES: NCCCCCCCCCCCCN
CH$IUPAC: InChI=1S/C12H28N2/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h1-14H2
CH$LINK: INCHIKEY QFTYSVGGYOXFRQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2044636

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-001i-9100000000-a4c2aa8b60d7479a5421
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  18 15.8 158
  27 2.52 25
  29 4.4 44
  30 99.99 999
  41 9.83 98
  42 3.02 30
  43 6.03 60
  44 25.45 255
  45 6.61 66
  55 8.61 86
  56 9.17 92
  57 2.82 28
  59 3.58 36
  69 5.43 54
  70 4.18 42
  72 4.71 47
  73 3.04 30
  83 3.12 31
  84 2.4 24
  86 5.45 55
  87 2.3 23
  97 2.31 23
  100 4.39 44
  102 4.29 43
  114 2.53 25
  128 3.86 39
  142 4.44 44
  156 5.38 54
  171 8.04 80
  184 5.79 58
//

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