Metabolite | [M+H]+ | Major Fragment Ions |
---|---|---|
m/z | ||
Bicifadine standard | 174 | 157 (-NH3), 142, 133 (base peak, -C2H3N), 129, 118, 105 (m/z 133-C2H4), 91 (tropylium ion), 82 |
M9 standard | 218 | 201 (-NH3), 200 (-H2O), 182, 171, 164, 146, 135 (base peak), 129, 118, 107, 96, 92, 83, 55 |
M12 standard | 188 | 171 (-NH3), 170 (-H2O), 143, 134, 105 (base peak), 96, 55 |
Bicifadine | 176 | 157 (-NH3), 142, 133 (base peak, -C2H3N), 129, 118, 105 (m/z 133-C2H4), 91 (tropylium ion), 82 |
M2 | 190 | 173 (-NH3), 160, 155, 149 (base peak, -C3H3N), 143 (m/z 175-C2H6), 128, 121 (m/z 149-C2H4), 93 |
M3 | 204 | 187 (-NH3), 169, 163 (base peak, -C2H3N), 143 (m/z 189-CO2), 135 (m/z 163-C2H4), 128, 117 |
M5 | 260 | 242 (-H2O), 218 (-acetyl), 202 (base peak), 200, 163, 146, 135, 97 |
M9 | 218 | 201 (-NH3), 200 (-H2O), 182, 171, 164, 146, 135 (base peak), 129, 118, 107, 96, 92, 83, 55 |
M10 | 190 | 172 (-H2O), 146, 134 (base peak, -C3H4O), 131, 117, 105, 91 (tropylium), 72, 57 |
M12 | 190 | 171 (-NH3), 170 (-H2O), 143, 134, 105 (base peak), 96, 55 |
M14A-B | 380 | 363 (-NH3), 339 (-C2H3N), 204 (-glucuronic acid), 186 (base peak, -H2O), 169, 157, 143 |
M14C | 380 | 204 (-glucuronic acid), 187 (base peak, -NH3), 186 (m/z 204-H2O), 175, 163, 143 |
M14D | 380 | 363 (-NH3), 362 (-H2O), 339 (-C2H3N), 204 (-glucuronic acid), 186 (base peak, -H2O), 169, 157, 146, 143 |
M14E | 380 | 363 (-NH3), 362 (-H2O), 204 (base peak, -glucuronic acid), 186 (m/z 204-H2O), 175, 157, 143, 113, 85 |
M14F | 380 | 363 (-NH3), 362 (-H2O), 339 (-C2H3N), 204 (-glucuronic acid), 186 (base peak, m/z-H2O), 175, 169, 141, 113, 85 |
M15 | 208 | 191 (-NH3), 173 (m/z 191-H2O), 145, 131 (base peak), 105 |
M17 | 206 | 189 (-NH3), 171 (m/z 189-H2O), 161 (m/z 189-CO), 143 (base peak, m/z 189-formic acid), 128, 119, 117, 105, 91, 73, 55 |
M19 | 218 | 201 (-NH3), 200 (-H2O), 156, 135 (base peak), 129, 107, 96, 80 |
M22 | 220 | 202 (-H2O), 161, 157, 135, 131, 119 (base peak), 117, 91, 84, 55 |
M23 | 254 | 295 (acetonitrile adduct), 174 (-sulfate), 157 (base peak, m/z 174-NH3), 145, 142, 131, 110, 105 |
M24 | 188 | 717 (-NH3), 170 (-H2O), 156, 105 (base peak), 93, 80 |
M25 | 325 | 200 (base peak, -NH(CH2)2SO3H), 171 (m/z 200-NH3), 157 (m/z 200-NHCO) |
M27 | 311 | 294 (-NH3), 270, 186 (base peak, -NH(CH2)2SO3H), 169 (m/z 186-NH3), 157 (m/z 186-NHCH2), 143, 119 |
M28A-B | 380 | 204 (base peak, -glucuronic acid), 186 (m/z 204-H2O), 159, 143, 141, 113, 105, 85 |
M29A | 436 | 419 (-NH3), 383, 365, 308, 243 (base peak), 219, 177, 159, 131, 123,107 |
M29B | 436 | 383, 365, 308, 267, 243 (base peak), 219, 177, 159, 131, 123,107 |
M30 | 205 | 187 (-H2O), 164, 159, 144, 141, 131 (base peak), 105, 91, 85, 73 |
M31C | 394 | 218 (-glucuronic acid), 200 (base peak, -H2O), 171, 113, 85 |
M31D-F | 394 | 218 (-glucuronic acid), 200 (base peak, -H2O), 171 |