ACCESSION: MSBNK-EPA-ENTACT_AGILENT000063
RECORD_TITLE: 9-Phenanthrol; ESI-QTOF; MS2; CE: 40; [M-H]-
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 9-Phenanthrol
CH$NAME: DTXSID9047592
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₁₀O
CH$EXACT_MASS: 194.0731649413
CH$SMILES: OC1=CC2C=CC=CC=2C2=CC=CC=C21
CH$IUPAC: InChI=1S/C14H10O/c15-14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9,15H
CH$LINK: CAS 484-17-3
CH$LINK: INCHIKEY DZKIUEHLEXLYKM-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:10229

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 40

MS$FOCUSED_ION: PRECURSOR_M/Z 193.0658884896
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-014l-0900000000-a239afb7f4e6f3c0c147
PK$NUM_PEAK: 3
PK$PEAK: m/z int. rel.int.
  164.063149 2.402613 24
  165.070974 100.000003 999
  193.065888 64.356257 642
//