ACCESSION: MSBNK-EPA-ENTACT_AGILENT001512
RECORD_TITLE: 2-Chloro-5-nitro-N-phenylbenzamide; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2-Chloro-5-nitro-N-phenylbenzamide
CH$NAME: DTXSID8040723
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₉ClN₂O₃
CH$EXACT_MASS: 276.0301698788
CH$SMILES: [O-][N+](=O)C1C=C(C(Cl)=CC=1)C(=O)NC1C=CC=CC=1
CH$IUPAC: InChI=1S/C13H9ClN2O3/c14-12-7-6-10(16(18)19)8-11(12)13(17)15-9-4-2-1-3-5-9/h1-8H,(H,15,17)
CH$LINK: CAS 22978-25-2
CH$LINK: INCHIKEY DNTSIBUQMRRYIU-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:644213

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 20

MS$FOCUSED_ION: PRECURSOR_M/Z 277.0374463305
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-003r-0890000000-9b73c270bd454715edbf
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
  95.049141 5.892528 58
  120.04439 5.304736 52
  120.992508 2.74221 27
  137.986694 5.696125 56
  183.979597 99.999995 999
  184.028559 1.115273 11
  199.013818 2.699058 26
  225.065854 1.357425 13
  230.036718 1.362618 13
  231.044543 30.304671 302
  246.031633 1.403854 14
  259.026882 6.018561 60
  277.037446 89.590695 895
//