MassBank Record: MSBNK-EPA-ENTACT_AGILENT000659

Ethyl 3-hydroxybenzoate; ESI-QTOF; MS2; CE: 20; [M-H]-

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ACCESSION: MSBNK-EPA-ENTACT_AGILENT000659
RECORD_TITLE: Ethyl 3-hydroxybenzoate; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

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CH$NAME: Ethyl 3-hydroxybenzoate
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₀O₃
CH$EXACT_MASS: 166.0629941859
CH$SMILES: CCOC(=O)C1C=CC=C(O)C=1
CH$IUPAC: InChI=1S/C9H10O3/c1-2-12-9(11)7-4-3-5-8(10)6-7/h3-6,10H,2H2,1H3
CH$LINK: CAS 7781-98-8
CH$LINK: INCHIKEY MWSMNBYIEBRXAL-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:24522

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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

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MS$FOCUSED_ION: PRECURSOR_M/Z 165.0557177342
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

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PK$SPLASH: splash10-0006-9000000000-5e1d2e7c2b8e16f2e15f
PK$NUM_PEAK: 6
PK$PEAK: m/z int. rel.int.
  92.026763 100.000004 999
  92.063149 2.895008 28
  93.034588 32.493862 324
  136.016593 1.530881 15
  137.024418 9.060675 90
  165.055718 4.399214 43
//