MassBank Record: MSBNK-EPA-ENTACT_AGILENT000467

Resorcinol monobenzoate; ESI-QTOF; MS2; CE: 10; [M-H]-

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ACCESSION: MSBNK-EPA-ENTACT_AGILENT000467
RECORD_TITLE: Resorcinol monobenzoate; 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$NAME: Resorcinol monobenzoate
CH$NAME: DTXSID1038878
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₁₀O₃
CH$EXACT_MASS: 214.0629941859
CH$SMILES: OC1=CC(=CC=C1)OC(=O)C1C=CC=CC=1
CH$IUPAC: InChI=1S/C13H10O3/c14-11-7-4-8-12(9-11)16-13(15)10-5-2-1-3-6-10/h1-9,14H
CH$LINK: CAS 136-36-7
CH$LINK: INCHIKEY GDESWOTWNNGOMW-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:8690

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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$FOCUSED_ION: PRECURSOR_M/Z 213.0557177342
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

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PK$SPLASH: splash10-02t9-0940000000-b9f7b0f56250157223fb
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
  77.039674 3.508597 35
  121.029503 18.184155 181
  135.008768 1.425525 14
  169.065888 100.000005 999
  213.055718 58.340457 582
//