ACCESSION: MSBNK-EPA-ENTACT_AGILENT001977
RECORD_TITLE: 3-Methoxy-5-methylphenol; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 3-Methoxy-5-methylphenol
CH$NAME: DTXSID1047443
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₀O₂
CH$EXACT_MASS: 138.0680795636
CH$SMILES: CC1C=C(C=C(O)C=1)OC
CH$IUPAC: InChI=1S/C8H10O2/c1-6-3-7(9)5-8(4-6)10-2/h3-5,9H,1-2H3
CH$LINK: CAS 3209-13-0
CH$LINK: INCHIKEY NOTCZLKDULMKBR-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:76674

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$FOCUSED_ION: PRECURSOR_M/Z 137.0608031119
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-00di-0900000000-bdc9c2bae20f0be80911
PK$NUM_PEAK: 4
PK$PEAK: m/z int. rel.int.
  93.034588 2.514686 25
  94.042413 3.77572 37
  122.037328 100.000001 999
  137.060803 3.625649 36
//