MassBank Record: MSBNK-EPA-ENTACT_AGILENT000658

Ethyl 3-hydroxybenzoate; ESI-QTOF; MS2; CE: 10; [M-H]-

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ACCESSION: MSBNK-EPA-ENTACT_AGILENT000658
RECORD_TITLE: Ethyl 3-hydroxybenzoate; ESI-QTOF; MS2; CE: 10; [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 10

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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$SPLASH: splash10-014l-4900000000-3f55908e9ebc6e3059fd
PK$NUM_PEAK: 6
PK$PEAK: m/z int. rel.int.
  92.026763 52.937807 528
  92.063149 1.200975 11
  93.034588 13.676622 136
  136.016593 9.751483 97
  137.024418 32.171316 321
  165.055718 100.000001 999
//