MassBank Record: JP003081



 ACETOPHENAZINE; EI-B; MS 
Mass Spectrum
Chemical Structure
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ACCESSION: JP003081
RECORD_TITLE: ACETOPHENAZINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: ACETOPHENAZINE CH$COMPOUND_CLASS: N/A CH$FORMULA: C23H29N3O2S CH$EXACT_MASS: 411.19805 CH$SMILES: OCCN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc(C(C)=O)3)Sc(cccc2)1 CH$IUPAC: InChI=1S/C23H29N3O2S/c1-18(28)19-7-8-23-21(17-19)26(20-5-2-3-6-22(20)29-23)10-4-9-24-11-13-25(14-12-24)15-16-27/h2-3,5-8,17,27H,4,9-16H2,1H3
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0h2f-7962200000-29f2e9055979e0add70b PK$NUM_PEAK: 134 PK$PEAK: m/z int. rel.int. 41 6.4 64 42 30.4 304 43 15.9 159 44 0.79 8 45 5.5 55 54 2.4 24 55 6.9 69 56 1.79 18 57 9.9 99 58 11.9 119 68 2.9 29 69 0.39 4 70 37.9 379 71 9.9 99 72 3.9 39 73 0.39 4 74 4.9 49 77 1.5 15 78 0.1 1 79 0.01 0 80 1.1 11 81 1.8 18 82 4.1 41 83 0.44 4 84 7.6 76 85 3.2 32 86 3 30 87 0.08 1 88 3.1 31 89 1.1 11 90 0.3 3 95 0.14 1 96 4.9 49 97 10.9 109 98 13.9 139 99 0.79 8 100 14.9 149 101 1.4 14 109 1.4 14 110 0.19 2 111 7.9 79 112 2.9 29 113 22.9 229 114 0.39 4 115 2.9 29 123 2.4 24 124 1.9 19 125 1.04 10 126 3.9 39 127 4.4 44 128 3.9 39 129 0.24 2 139 9.4 94 140 2.4 24 141 7.9 79 142 0.14 1 143 55.9 559 144 4.9 49 152 0.9 9 153 0.69 7 154 1.9 19 155 0.9 9 157 24.9 249 158 0.29 3 159 0.9 9 166 1.4 14 167 1.9 19 168 0.09 1 169 4.4 44 170 2.4 24 171 19.9 199 172 0.34 3 177 0.4 4 178 1.9 19 179 3.9 39 180 0.26 3 189 3.9 39 190 17.9 179 191 1.9 19 192 0.04 0 193 0.9 9 194 0.9 9 196 3.9 39 197 0.89 9 198 4.9 49 199 1.9 19 200 0.9 9 209 0.09 1 210 2.9 29 211 3.4 34 212 5.9 59 213 0.14 1 214 0.9 9 222 14.9 149 223 4.9 49 224 0.29 3 225 2.4 24 226 1.9 19 240 13.9 139 241 0.99 10 242 2.9 29 243 0.9 9 254 99.99 999 255 3.59 36 256 10.9 109 257 2.9 29 267 2.4 24 268 0.84 8 269 5.4 54 270 2.4 24 280 7.9 79 281 0.79 8 282 2.9 29 283 1.4 14 310 2.4 24 311 0.19 2 324 3.9 39 325 1.4 14 337 3.6 36 338 0.11 1 380 27.4 274 381 7.9 79 382 2.9 29 383 0.09 1 393 8.1 81 394 3 30 395 1.4 14 396 0.09 1 409 2.4 24 410 1.9 19 411 51.9 519 412 1.64 16 413 5.9 59 414 1.4 14 //