ACCESSION: MSBNK-EPA-ENTACT_AGILENT000910
RECORD_TITLE: Phenethyl anthranilate; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: Phenethyl anthranilate
CH$NAME: DTXSID5025861
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₁₅NO₂
CH$EXACT_MASS: 241.1102787305
CH$SMILES: NC1=CC=CC=C1C(=O)OCCC1C=CC=CC=1
CH$IUPAC: InChI=1S/C15H15NO2/c16-14-9-5-4-8-13(14)15(17)18-11-10-12-6-2-1-3-7-12/h1-9H,10-11,16H2
CH$LINK: CAS 133-18-6
CH$LINK: INCHIKEY PXWNBAGCFUDYBE-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:8615

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 40

MS$FOCUSED_ION: PRECURSOR_M/Z 242.1175551822
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-056u-9700000000-94905fabeb1ddd08334a
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
  39.022927 1.055298 10
  51.022927 5.589031 55
  65.038577 29.261673 292
  77.038577 51.554592 515
  79.054227 49.437988 493
  91.054227 2.198661 21
  92.049476 58.434726 583
  92.083181 1.067086 10
  103.054227 31.63324 316
  105.069877 99.999997 999
  120.04439 24.22022 241
//