MassBank Record: WA001264



 Loprazolam; LC-ESI-Q; MS; POS; 90 V 
Mass Spectrum
Chemical Structure
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ACCESSION: WA001264
RECORD_TITLE: Loprazolam; LC-ESI-Q; MS; POS; 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$NAME: Loprazolam CH$COMPOUND_CLASS: N/A CH$FORMULA: C23H21ClN6O3 CH$EXACT_MASS: 464.13637 CH$SMILES: CN(C5)CCN(C5)C=c(n4)c(=O)n(c24)c(c3)c(cc(N(=O)=O)c3)C(=NC2)c(c1)c(Cl)ccc1 CH$IUPAC: InChI=1S/C23H21ClN6O3/c1-27-8-10-28(11-9-27)14-19-23(31)29-20-7-6-15(30(32)33)12-17(20)22(25-13-21(29)26-19)16-4-2-3-5-18(16)24/h2-7,12,14H,8-11,13H2,1H3/b19-14+ CH$LINK: CAS 61197-73-7
AC$INSTRUMENT: ZQ, Waters AC$INSTRUMENT_TYPE: LC-ESI-Q AC$CHROMATOGRAPHY: RETENTION_TIME 13.400 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 90 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-0ik9-0977400000-902a1eaf56478d3ef9e0 PK$NUM_PEAK: 198 PK$PEAK: m/z int. rel.int. 107 39 39 108 55 55 109 247 247 111 999 999 112 98 98 121 63 63 122 20 20 123 125 125 125 357 357 127 125 125 135 35 35 136 24 24 138 67 67 139 20 20 149 31 31 151 27 27 156 16 16 162 20 20 163 24 24 164 12 12 166 121 121 167 16 16 190 106 106 191 20 20 197 12 12 205 16 16 206 16 16 207 12 12 214 8 8 217 106 106 218 31 31 219 16 16 220 12 12 224 12 12 225 31 31 227 16 16 229 12 12 231 8 8 233 27 27 234 12 12 235 16 16 238 8 8 239 12 12 240 94 94 241 24 24 242 74 74 243 20 20 244 20 20 246 8 8 252 474 474 253 86 86 254 290 290 255 47 47 256 59 59 257 20 20 258 24 24 259 16 16 263 82 82 264 20 20 266 27 27 268 24 24 269 20 20 270 27 27 271 31 31 272 12 12 273 12 12 278 12 12 279 12 12 280 16 16 281 16 16 282 8 8 283 16 16 284 12 12 285 16 16 286 20 20 287 8 8 288 31 31 289 8 8 290 8 8 291 12 12 292 12 12 293 39 39 294 16 16 295 12 12 296 8 8 298 149 149 299 47 47 300 129 129 301 31 31 302 39 39 303 16 16 304 12 12 305 20 20 306 8 8 307 24 24 308 12 12 309 16 16 310 20 20 311 8 8 312 16 16 313 8 8 314 8 8 315 8 8 316 125 125 317 35 35 318 39 39 319 24 24 320 12 12 321 47 47 322 16 16 323 31 31 324 12 12 325 20 20 326 16 16 327 20 20 328 8 8 331 12 12 332 16 16 333 20 20 334 43 43 335 31 31 336 20 20 337 24 24 338 12 12 339 102 102 340 24 24 341 31 31 342 8 8 343 16 16 344 74 74 345 16 16 346 31 31 347 16 16 348 16 16 349 8 8 350 12 12 351 55 55 352 12 12 353 39 39 354 12 12 355 16 16 357 16 16 358 12 12 360 16 16 361 8 8 362 141 141 363 39 39 364 55 55 365 24 24 366 8 8 367 71 71 368 16 16 369 27 27 370 8 8 372 8 8 373 8 8 376 59 59 377 20 20 378 43 43 379 20 20 380 43 43 381 39 39 382 24 24 383 12 12 388 8 8 390 47 47 391 20 20 392 20 20 393 8 8 394 16 16 395 8 8 396 8 8 402 12 12 404 8 8 406 8 8 408 215 215 409 31 31 410 78 78 411 16 16 419 24 24 420 8 8 422 78 78 423 12 12 424 24 24 434 8 8 435 8 8 436 8 8 465 180 180 466 31 31 467 67 67 468 12 12 487 274 274 488 51 51 489 102 102 490 20 20 503 63 63 504 20 20 505 31 31 //