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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000540

N,N-Dimethyl-4-nitrosoaniline; ESI-QTOF; MS2; CE: 40; [M+H]+

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000540
RECORD_TITLE: N,N-Dimethyl-4-nitrosoaniline; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: N,N-Dimethyl-4-nitrosoaniline
CH$NAME: DTXSID7025138
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H10N2O
CH$EXACT_MASS: 150.0793129561
CH$SMILES: CN(C)C1C=CC(=CC=1)N=O
CH$IUPAC: InChI=1S/C8H10N2O/c1-10(2)8-5-3-7(9-11)4-6-8/h3-6H,1-2H3
CH$LINK: CAS 138-89-6
CH$LINK: INCHIKEY CMEWLCATCRTSGF-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:8749

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40

MS$FOCUSED_ION: PRECURSOR_M/Z 151.0865894078
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-014l-9300000000-12e5631d118ab784ef18
PK$NUM_PEAK: 51
PK$PEAK: m/z int. rel.int.
  39.022927 8.84339 88
  41.038577 3.401878 33
  42.033826 19.102469 190
  51.022927 25.703761 256
  52.018175 7.001244 69
  52.030752 1.631242 16
  53.038577 3.361971 33
  55.041651 1.170985 11
  56.049476 1.573228 15
  63.022927 2.76817 27
  63.994366 2.389461 23
  64.018175 1.717609 17
  64.030752 2.925304 29
  65.038577 100.000003 999
  65.070939 1.84661 18
  65.083515 1.083842 10
  66.033826 24.261015 242
  67.041651 11.354452 113
  68.049476 34.87765 348
  77.038577 22.070263 220
  78.033826 33.051287 330
  79.041651 2.281565 22
  79.054227 17.957793 179
  80.049476 6.106086 60
  81.057301 4.246292 42
  82.065126 5.491121 54
  89.038577 1.096325 10
  90.033826 6.291287 62
  91.041651 8.774077 87
  91.054227 3.785682 37
  92.049476 73.70994 736
  93.044725 35.662912 356
  93.057301 17.306325 172
  94.065126 2.361737 23
  104.049476 4.472922 44
  105.044725 2.373584 23
  105.057301 4.079936 40
  106.065126 23.040016 230
  107.060375 1.784856 17
  107.072951 1.607229 16
  108.080776 1.967253 19
  116.049476 5.002688 49
  117.044725 1.461306 14
  117.057301 3.07852 30
  118.05255 33.02084 329
  119.060375 25.23305 252
  120.080776 7.037883 70
  131.060375 2.567752 25
  132.0682 7.091206 70
  133.076025 46.821833 467
  134.08385 1.903955 19
//

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