MassBank Record: WA000135



 Phenmedipham; LC-ESI-QQ; MS2; CE:30 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA000135
RECORD_TITLE: Phenmedipham; LC-ESI-QQ; MS2; CE:30 V; [M+H]+
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$NAME: Phenmedipham CH$COMPOUND_CLASS: N/A CH$FORMULA: C16H16N2O4 CH$EXACT_MASS: 300.11101 CH$SMILES: COC(=O)Nc(c2)cc(cc2)OC(=O)Nc(c1)cc(C)cc1 CH$IUPAC: InChI=1S/C16H16N2O4/c1-11-5-3-6-12(9-11)18-16(20)22-14-8-4-7-13(10-14)17-15(19)21-2/h3-10H,1-2H3,(H,17,19)(H,18,20) CH$LINK: CAS 13684-63-4
AC$INSTRUMENT: QuattroPremier XE, Waters AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 30 V
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+ MS$FOCUSED_ION: PRECURSOR_M/Z 318.2 MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-000i-0900000000-80d8defd67fd5073f084 PK$NUM_PEAK: 6 PK$PEAK: m/z int. rel.int. 65 8 8 92 102 102 108 180 180 136 999 999 137 24 24 168 47 47 //