ACCESSION: MSBNK-EPA-ENTACT_AGILENT000591
RECORD_TITLE: 2,4-Bis(1-methyl-1-phenylethyl)phenol; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2,4-Bis(1-methyl-1-phenylethyl)phenol
CH$NAME: DTXSID7029241
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₄H₂₆O
CH$EXACT_MASS: 330.1983654517
CH$SMILES: CC(C)(C1=CC(=C(O)C=C1)C(C)(C)C1C=CC=CC=1)C1C=CC=CC=1
CH$IUPAC: InChI=1S/C24H26O/c1-23(2,18-11-7-5-8-12-18)20-15-16-22(25)21(17-20)24(3,4)19-13-9-6-10-14-19/h5-17,25H,1-4H3
CH$LINK: CAS 2772-45-4
CH$LINK: INCHIKEY FMUYQRFTLHAARI-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:76013

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$FOCUSED_ION: PRECURSOR_M/Z 329.191089
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-004i-0009000000-14d98c7bae5c62c39753
PK$NUM_PEAK: 3
PK$PEAK: m/z int. rel.int.
  313.159789 1.897799 18
  314.167614 11.088704 110
  329.191089 99.999996 999
//