MassBank Record: MSBNK-EPA-ENTACT_AGILENT002242

Benzyl acetate; ESI-QTOF; MS2; CE: 20; [M+H]+

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ACCESSION: MSBNK-EPA-ENTACT_AGILENT002242
RECORD_TITLE: Benzyl acetate; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

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CH$NAME: Benzyl acetate
CH$NAME: DTXSID0020151
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₀O₂
CH$EXACT_MASS: 150.0680795636
CH$SMILES: CC(=O)OCC1C=CC=CC=1
CH$IUPAC: InChI=1S/C9H10O2/c1-8(10)11-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3
CH$LINK: CAS 140-11-4
CH$LINK: INCHIKEY QUKGYYKBILRGFE-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:8785

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AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20

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MS$FOCUSED_ION: PRECURSOR_M/Z 151.0753560153
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

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PK$SPLASH: splash10-004i-9000000000-34518ab26a581ae39f9a
PK$NUM_PEAK: 6
PK$PEAK: m/z int. rel.int.
  45.033491 18.031528 180
  61.007276 10.672765 106
  62.015101 1.554833 15
  63.994366 27.860962 278
  79.017841 99.999997 999
  79.054227 2.626562 26
//