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MassBank Record: JP002933

N,N-DIETHYL ETHANOLAMINE; EI-B; MS

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

ACCESSION: JP002933
RECORD_TITLE: N,N-DIETHYL ETHANOLAMINE; 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$NAME: N,N-DIETHYL ETHANOLAMINE
CH$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$LINK: INCHIKEY BFSVOASYOCHEOV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5021837

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$SPLASH: splash10-000i-9000000000-679642371f35e680a216
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  15 3.26 33
  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
  58 39.65 397
  70 2.03 20
  72 3.62 36
  86 99.99 999
  87 6.28 63
  102 6.53 65
  116 2.91 29
  117 4.18 42
//

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