ACCESSION: MSBNK-EPA-ENTACT_AGILENT002400
RECORD_TITLE: 2-Methyl-1-phenylpropan-2-ol; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2-Methyl-1-phenylpropan-2-ol
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₄O
CH$EXACT_MASS: 150.1044650689
CH$SMILES: CC(C)(O)CC1C=CC=CC=1
CH$IUPAC: InChI=1S/C10H14O/c1-10(2,11)8-9-6-4-3-5-7-9/h3-7,11H,8H2,1-2H3
CH$LINK: CAS 100-86-7
CH$LINK: INCHIKEY RIWRBSMFKVOJMN-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:7531

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10

MS$FOCUSED_ION: PRECURSOR_M/Z 151.1117415206
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-004i-9000000000-d724c903e105da7350df
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
  61.007276 1.135929 11
  63.994366 2.55563 25
  79.017841 100.000004 999
  79.054227 3.772993 37
  80.025666 2.151626 21
//