MassBank Record: MSBNK-EPA-ENTACT_AGILENT000555
ACCESSION: MSBNK-EPA-ENTACT_AGILENT000555
RECORD_TITLE: N-(2-Fluorenyl)-2,2,2-trifluoroacetamide; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: N-(2-Fluorenyl)-2,2,2-trifluoroacetamide
CH$NAME: DTXSID3020629
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H10F3NO
CH$EXACT_MASS: 277.0714485487
CH$SMILES: O=C(NC1=CC2CC3=CC=CC=C3C=2C=C1)C(F)(F)F
CH$IUPAC: InChI=1S/C15H10F3NO/c16-15(17,18)14(20)19-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8H,7H2,(H,19,20)
CH$LINK: CAS
363-17-7
CH$LINK: INCHIKEY
XPHPBNGAXWJHHP-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:9690
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$FOCUSED_ION: PRECURSOR_M/Z 276.064172097
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-014i-9030000000-3499b0e80a3e21fc9c53
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
68.995758 100.000003 999
69.039554 2.455118 24
69.05213 1.172494 11
206.061137 38.155552 381
276.064172 1.741222 17
//
system version 2.2.8-SNAPSHOT