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. Author manuscript; available in PMC: 2009 Jun 1.
Published in final edited form as: Chem Res Toxicol. 2008 May 31;21(6):1244–1252. doi: 10.1021/tx800067s

Table 1.

Product ions and representative losses for [4-OH-E1-(un-, 8-13C- and U-15N-labeled)-1-N3Ade + H]+. Number of 15N loss is shown in parenthesis for [4-OH-E1-1-N3(U-15N)Ade + H]+. Relative abundances of dual species with same nominal mass are shown in brackets

un-(m/z = 420) 8-13C (m/z = 421) U-15N (m/z = 425) Neutral loss from parent
418 419 423 (0) H2
403 404 407 (1) NH3
402 403 407 (0) H2O
401 402 405 (1) NH3 + H2
400 401 405 (0) H2O + H2
392 393 397 (0) CO [60%]
391 392 395 (1) CH2NH
386 387 389 (2) (NH3)2
385 386 389 (1) NH3 + H2O
383 384 387 (1) NH3 + H2O + H2
375 376 379 (1) NH3 + CO
373 374 377 (1) H2O + CH2NH
368 369 371 (2) H2O + (NH3)2
367 368 371 (1) (H2O)2 + NH3
363 364 367 (1) CH2NH + CO
362 363 365 (2) (CH2NH)2 [45%]
367 (0) C3H6O [55%]
357 358 361 (1) NH3 + H2O + CO [90%]
NH3 + H2O + C2H4 [10%]
355 356 359 (1) CH2NH + (H2O)2
345 346 349 (1) CH2NH + H2O + CO [70%]
CH2NH + H2O + C2H4 [30%]
339 340 343 (1) NH3 + (H2O)2 + CO
327 328 331 (1) (H2O)2 + CH2NH + CO [90%]
(H2O)2 + CH2NH + C2H4 [10%]
310 311 315 (0) C7H10O
308 309 313 (0) C7H10O + H2
296 297 301 (0) C8H12O
294 295 299 (0) C8H14O
282 283 287 (0) C9H14O
281 282 285 (1) CH2NH + C7H10O
257 258 262 (0) C11H15O
256 257 261 (0) C11H16O
255 256 259 (1) CH2NH + C9H12O
230 231 234 (1) CH2NH + C11H13O
229 230 233 (1) CH2NH + C11H14O
201 202 205 (1) C13H17O2Na
136 137 141 (0) catechol estrone quinone a