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MassBank Record: MSBNK-Waters-WA001925

Fenozolone; LC-ESI-Q; MS; POS; 15 V

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Waters-WA001925
RECORD_TITLE: Fenozolone; LC-ESI-Q; MS; POS; 15 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2012.05.21)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Fenozolone
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H12N2O2
CH$EXACT_MASS: 204.08988
CH$SMILES: CCNC(=N2)OC(C(=O)2)c(c1)cccc1
CH$IUPAC: InChI=1S/C11H12N2O2/c1-2-12-11-13-10(14)9(15-11)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H,12,13,14)
CH$LINK: CAS 15302-16-6
CH$LINK: INCHIKEY RXOIEVSUURELPG-UHFFFAOYSA-N

AC$INSTRUMENT: ZQ, Waters
AC$INSTRUMENT_TYPE: LC-ESI-Q
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$CHROMATOGRAPHY: RETENTION_TIME 13.040 min
AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: SAMPLING_CONE 15 V

MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5

PK$SPLASH: splash10-0a4i-0090200000-5dc47055904f154416ee
PK$ANNOTATION: m/z type
  227 [M+Na]+
  409 [2M+H]+
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  134 27 27
  163 59 59
  164 8 8
  179 31 31
  205 999 999
  206 125 125
  207 12 12
  227 12 12
  243 12 12
  246 12 12
  409 192 192
  410 51 51
  431 35 35
  432 8 8
//

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