MassBank Record: MSBNK-EPA-ENTACT_AGILENT000747

2,6-Dibromo-4-nitroaniline; ESI-QTOF; MS2; CE: 10; [M-H]-

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ACCESSION: MSBNK-EPA-ENTACT_AGILENT000747
RECORD_TITLE: 2,6-Dibromo-4-nitroaniline; ESI-QTOF; MS2; CE: 10; [M-H]-
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

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CH$NAME: 2,6-Dibromo-4-nitroaniline
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₄Br₂N₂O₂
CH$EXACT_MASS: 293.863953187
CH$SMILES: NC1C(Br)=CC(=CC=1Br)[N+]([O-])=O
CH$IUPAC: InChI=1S/C6H4Br2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2
CH$LINK: CAS 827-94-1
CH$LINK: INCHIKEY YMZIFDLWYUSZCC-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:13231

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AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10

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MS$FOCUSED_ION: PRECURSOR_M/Z 292.8566767353
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

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PK$SPLASH: splash10-0006-0090000000-f6465e6a4f3191666c45
PK$NUM_PEAK: 3
PK$PEAK: m/z int. rel.int.
  78.918886 2.314461 23
  212.930514 1.461706 14
  292.856677 100.000005 999
//