MassBank Record: MSBNK-EPA-ENTACT_AGILENT001604
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001604
RECORD_TITLE: 4,4'-(9H-Fluorene-9,9-diyl)diphenol; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: 4,4'-(9H-Fluorene-9,9-diyl)diphenol
CH$NAME: DTXSID5037731
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C25H18O2
CH$EXACT_MASS: 350.1306798188
CH$SMILES: OC1C=CC(=CC=1)C1(C2C=CC=CC=2C2C=CC=CC1=2)C1C=CC(O)=CC=1
CH$IUPAC: InChI=1S/C25H18O2/c26-19-13-9-17(10-14-19)25(18-11-15-20(27)16-12-18)23-7-3-1-5-21(23)22-6-2-4-8-24(22)25/h1-16,26-27H
CH$LINK: CAS
3236-71-3
CH$LINK: INCHIKEY
YWFPGFJLYRKYJZ-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:76716
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$FOCUSED_ION: PRECURSOR_M/Z 349.1234033671
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-052b-0059000000-23a7e9eb4a47ede3c4d9
PK$NUM_PEAK: 4
PK$PEAK: m/z int. rel.int.
215.086624 1.096605 10
256.089364 64.974969 649
348.115578 1.468749 14
349.123403 99.999999 999
//