MassBank Record: WA002309



 Carbidopa; LC-ESI-Q; MS; NEG; 60 V, 90 V 
Mass Spectrum
Chemical Structure
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ACCESSION: WA002309
RECORD_TITLE: Carbidopa; LC-ESI-Q; MS; NEG; 60 V, 90 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$NAME: Carbidopa CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H14N2O4 CH$EXACT_MASS: 226.09536 CH$SMILES: NNC(C)(C(O)=O)Cc(c1)cc(O)c(O)c1 CH$IUPAC: InChI=1S/C10H14N2O4/c1-10(12-11,9(15)16)5-6-2-3-7(13)8(14)4-6/h2-4,12-14H,5,11H2,1H3,(H,15,16)/t10-/m0/s1 CH$LINK: CAS 28860-95-9
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 3.120 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 60 V, 90 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-00di-0920000000-9eee4c9cc38ee0ef4f9a PK$NUM_PEAK: 98 PK$PEAK: m/z int. rel.int. 101 165 165 103 8 8 104 12 12 105 35 35 106 20 20 107 43 43 108 168 168 109 443 443 110 12 12 113 12 12 115 8 8 116 12 12 117 8 8 118 20 20 119 20 20 121 145 145 122 404 404 123 999 999 124 51 51 125 20 20 130 16 16 131 20 20 132 20 20 133 27 27 134 27 27 138 24 24 139 27 27 143 8 8 144 12 12 145 12 12 147 35 35 148 55 55 149 407 407 150 31 31 153 8 8 157 8 8 158 12 12 162 71 71 163 20 20 164 172 172 165 12 12 168 16 16 174 27 27 175 8 8 176 16 16 177 16 16 178 12 12 179 16 16 180 12 12 181 16 16 184 8 8 188 31 31 189 8 8 191 39 39 193 16 16 195 24 24 197 8 8 199 16 16 204 8 8 205 20 20 206 16 16 207 16 16 209 24 24 211 8 8 217 31 31 219 24 24 220 31 31 223 12 12 225 176 176 226 24 24 227 27 27 234 8 8 235 8 8 238 24 24 241 8 8 247 98 98 249 47 47 250 8 8 251 20 20 256 20 20 257 20 20 258 16 16 259 8 8 261 12 12 262 12 12 264 12 12 265 8 8 269 8 8 271 27 27 272 8 8 274 39 39 278 8 8 281 12 12 283 8 8 284 16 16 287 12 12 288 12 12 289 12 12 //