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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000506

2,3-Dihydroxynaphthalene; ESI-QTOF; MS2; CE: 20; [M-H]-

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000506
RECORD_TITLE: 2,3-Dihydroxynaphthalene; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2,3-Dihydroxynaphthalene
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H8O2
CH$EXACT_MASS: 160.0524294998
CH$SMILES: OC1=CC2C=CC=CC=2C=C1O
CH$IUPAC: InChI=1S/C10H8O2/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-6,11-12H
CH$LINK: CAS 92-44-4
CH$LINK: INCHIKEY JRNGUTKWMSBIBF-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:7091

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

PK$SPLASH: splash10-0a59-0900000000-6b7c467c2619ff19f3c9
PK$NUM_PEAK: 8
PK$PEAK: m/z int. rel.int.
  103.055324 1.135432 11
  113.039674 6.250363 62
  115.055324 3.264923 32
  130.042413 14.473219 144
  131.050238 36.865734 368
  141.034588 10.116499 101
  158.037328 3.799117 37
  159.045153 100 999
//

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