MassBank Record: MSBNK-AGILENT-AG000053

Carbofuran; ESI-QTOF; MS2; CE: 10; [M+H]+

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ACCESSION: MSBNK-AGILENT-AG000053
RECORD_TITLE: Carbofuran; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.02.17
AUTHORS: Rennie E, McEachran A, Agilent Technologies
LICENSE: CC BY

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CH$NAME: Carbofuran
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₅NO₃
CH$EXACT_MASS: 221.10519
CH$SMILES: CNC(=O)OC1=CC=CC2CC(C)(C)OC1=2
CH$IUPAC: InChI=1S/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)
CH$LINK: CAS 1563-66-2
CH$LINK: CHEMSPIDER 2468
CH$LINK: INCHIKEY DUEPRVBVGDRKAG-UHFFFAOYSA-N

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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 10

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MS$FOCUSED_ION: PRECURSOR_M/Z 222.1124698045
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+

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PK$SPLASH: splash10-014i-0900000000-80ba0b777b173b74fdf2
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  55.054227 2.122564 21
  119.085527 1.121048 11
  123.044056 32.299852 322
  137.059706 2.262973 22
  147.080441 1.201063 11
  165.091006 100 999
  222.11247 9.644423 96
//