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MassBank Record: JP008253

N,N-DIETHYLETHANOLAMINE; EI-B; MS

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

ACCESSION: JP008253
RECORD_TITLE: N,N-DIETHYLETHANOLAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UBE SCIENTIFIC ANALYSIS LABORATORY
LICENSE: CC BY-NC-SA

CH$NAME: N,N-DIETHYLETHANOLAMINE
CH$NAME: 2-DIETHYLAMINOETHANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H15NO
CH$EXACT_MASS: 117.11536
CH$SMILES: OCCN(CC)CC
CH$IUPAC: InChI=1S/C6H15NO/c1-3-7(4-2)5-6-8/h8H,3-6H2,1-2H3
CH$LINK: CAS 100-37-8
CH$LINK: INCHIKEY BFSVOASYOCHEOV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5021837

AC$INSTRUMENT: HITACHI M-60
AC$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$SPLASH: splash10-000i-9000000000-4babed528318afee1202
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  15 3.26 33
  17 1.3 13
  27 8.98 90
  28 10.78 108
  29 13.28 133
  30 38.09 381
  31 2.56 26
  39 2.05 21
  41 2.35 24
  42 9.8 98
  43 3.14 31
  44 6.04 60
  45 5.84 58
  56 8.17 82
  57 1.72 17
  58 39.65 397
  59 1.77 18
  60 1.02 10
  70 2.03 20
  71 1.28 13
  72 3.62 36
  86 99.99 999
  87 6.28 63
  88 1.65 17
  102 6.53 65
  116 2.91 29
  117 4.18 42
//

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