MassBank Record: WA002693



 Ioxynil; LC-ESI-Q; MS; NEG; 15 V, 30 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA002693
RECORD_TITLE: Ioxynil; LC-ESI-Q; MS; NEG; 15 V, 30 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: Copyright 2007-2011 Nihon Waters K.K.

CH$NAME: Ioxynil CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H3I2NO CH$EXACT_MASS: 370.83040 CH$SMILES: N#Cc(c1)cc(I)c(O)c(I)1 CH$IUPAC: InChI=1S/C7H3I2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H CH$LINK: CAS 1689-83-4
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 17.310 min AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C AC$MASS_SPECTROMETRY: IONIZATION ESI AC$CHROMATOGRAPHY: SAMPLING_CONE 15 V, 30 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-00di-0039000000-a1f9a4aa5c8fbabc71fc PK$NUM_PEAK: 9 PK$PEAK: m/z int. rel.int. 118 35 35 127 59 59 244 235 235 245 16 16 260 102 102 274 27 27 370 999 999 371 71 71 381 16 16 //