MassBank Record: WA001325



 Carbetamide; LC-ESI-Q; MS; POS; 60 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA001325
RECORD_TITLE: Carbetamide; LC-ESI-Q; MS; POS; 60 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$NAME: Carbetamide CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H16N2O3 CH$EXACT_MASS: 236.11609 CH$SMILES: CCNC(=O)C([H])(C)OC(=O)Nc(c1)cccc1 CH$IUPAC: InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)/t9-/m1/s1 CH$LINK: CAS 16118-49-3
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 14.800 min AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE 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 60 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-00xr-0900000000-4b4f968f5a0a145c18e7 PK$NUM_PEAK: 25 PK$PEAK: m/z int. rel.int. 100 137 137 101 8 8 103 8 8 105 71 71 106 16 16 109 16 16 117 12 12 118 960 960 119 8 8 120 999 999 121 59 59 126 8 8 133 106 106 134 27 27 136 8 8 140 16 16 149 8 8 156 8 8 166 8 8 185 12 12 192 8 8 237 8 8 259 43 43 275 24 24 287 8 8 //