ACCESSION: MSBNK-EPA-ENTACT_AGILENT001357
RECORD_TITLE: 2,7-Acetylaminofluorene; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2,7-Acetylaminofluorene
CH$NAME: DTXSID9021479
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₇H₁₆N₂O₂
CH$EXACT_MASS: 280.1211777698
CH$SMILES: CC(=O)NC1C=C2CC3C=C(C=CC=3C2=CC=1)NC(C)=O
CH$IUPAC: InChI=1S/C17H16N2O2/c1-10(20)18-14-3-5-16-12(8-14)7-13-9-15(19-11(2)21)4-6-17(13)16/h3-6,8-9H,7H2,1-2H3,(H,18,20)(H,19,21)
CH$LINK: CAS 304-28-9
CH$LINK: INCHIKEY XBZBRCVCSVLJJZ-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:9352

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 20

MS$FOCUSED_ION: PRECURSOR_M/Z 279.1139013181
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-004r-0090000000-c98a89f3c0eebbb0827e
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  41.998537 1.490201 14
  194.084947 10.460671 104
  195.092772 2.57547 25
  210.092438 2.091036 20
  221.072037 4.494829 44
  236.095512 8.058438 80
  237.103337 87.284831 871
  238.099928 2.147674 21
  263.082601 4.587054 45
  279.113901 100 999
//