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MassBank Record: JP003290

N,N-DIISOBUTYLNITROSOAMINE; EI-B; MS

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

ACCESSION: JP003290
RECORD_TITLE: N,N-DIISOBUTYLNITROSOAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: N,N-DIISOBUTYLNITROSOAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H18N2O
CH$EXACT_MASS: 158.14191
CH$SMILES: O=NN(CC(C)C)CC(C)C
CH$IUPAC: InChI=1S/C8H18N2O/c1-7(2)5-10(9-11)6-8(3)4/h7-8H,5-6H2,1-4H3
CH$LINK: INCHIKEY XLZCLFRMPCBSDI-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID90244219

AC$INSTRUMENT: VARIAN MAT-44
AC$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$SPLASH: splash10-0a4i-9000000000-798c08102f15dfb9267f
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
  54 2.28 23
  55 21.74 217
  56 31.04 310
  57 99.99 999
  58 3.93 39
  70 4.57 46
  72 3.02 30
  73 8.42 84
  84 35.62 356
  85 5.9 59
  86 5.44 54
  103 2.28 23
  115 3.29 33
//

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