ACCESSION: MSBNK-EPA-ENTACT_AGILENT000368
RECORD_TITLE: 1,5-Dihydroxynaphthalene; ESI-QTOF; MS2; CE: 40; [M-H]-
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 1,5-Dihydroxynaphthalene
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₈O₂
CH$EXACT_MASS: 160.0524294998
CH$SMILES: OC1C=CC=C2C=1C=CC=C2O
CH$IUPAC: InChI=1S/C10H8O2/c11-9-5-1-3-7-8(9)4-2-6-10(7)12/h1-6,11-12H
CH$LINK: CAS 83-56-7
CH$LINK: INCHIKEY BOKGTLAJQHTOKE-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:6749

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$FOCUSED_ION: PRECURSOR_M/Z 159.0451530481
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-014i-4900000000-088af568d854590a7e01
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  41.003288 44.938236 448
  49.008374 3.07985 30
  53.003288 1.614618 16
  65.039674 3.733355 37
  75.024024 1.169909 11
  77.039674 1.950338 19
  88.031849 4.31436 43
  93.034588 1.680138 16
  101.039674 2.542771 25
  102.047499 4.173425 41
  103.055324 3.200075 31
  114.047499 2.892256 28
  115.055324 100 999
  130.042413 7.489261 74
  131.050238 3.90796 39
  158.037328 8.922187 89
//