ACCESSION: MSBNK-EPA-ENTACT_AGILENT001320
RECORD_TITLE: 3-Hydroxy-2-naphthoic o-anisidide; ESI-QTOF; MS2; CE: 40; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 3-Hydroxy-2-naphthoic o-anisidide
CH$NAME: DTXSID6038877
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₈H₁₅NO₃
CH$EXACT_MASS: 293.1051933528
CH$SMILES: COC1=CC=CC=C1NC(=O)C1=CC2C=CC=CC=2C=C1O
CH$IUPAC: InChI=1S/C18H15NO3/c1-22-17-9-5-4-8-15(17)19-18(21)14-10-12-6-2-3-7-13(12)11-16(14)20/h2-11,20H,1H3,(H,19,21)
CH$LINK: CAS 135-62-6
CH$LINK: INCHIKEY AQYMRQUYPFCXDM-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:67274

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$FOCUSED_ION: PRECURSOR_M/Z 292.0979169011
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0a59-0900000000-fd3bc63845557ab4bb99
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  41.998537 1.772475 17
  107.037662 99.999999 999
  107.074048 2.615072 26
  114.047499 20.183373 201
  115.055324 9.372785 93
  134.024752 84.531773 844
  134.073714 2.04981 20
  134.082267 1.139936 11
  142.042413 7.2544 72
  143.050238 40.3917 403
  168.045487 2.655177 26
  232.076788 1.207123 12
  233.060803 1.659213 16
  260.071702 1.034248 10
  276.066617 5.429036 54
//