MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000236

1-HEPTYLAMINE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000236
RECORD_TITLE: 1-HEPTYLAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

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CH$NAME: 1-HEPTYLAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₁₇N
CH$EXACT_MASS: 115.13610
CH$SMILES: CCCCCCCN
CH$IUPAC: InChI=1S/C7H17N/c1-2-3-4-5-6-7-8/h2-8H2,1H3
CH$LINK: INCHIKEY WJYIASZWHGOTOU-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7020681

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AC$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-001i-9000000000-3e4c53fea4cfa1621d3d
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  18 4.5 45
  27 5.6 56
  28 3.6 36
  29 0.43 4
  30 99.99 999
  31 2 20
  39 3.7 37
  41 0.68 7
  42 2.6 26
  43 3.1 31
  44 6.1 61
  45 0.47 5
  55 3.2 32
  56 2.4 24
  86 1.9 19
  115 1.8 18
//