MassBank Record: JP002763



 PERPHENAZINE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002763
RECORD_TITLE: PERPHENAZINE; 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$NAME: PERPHENAZINE CH$COMPOUND_CLASS: N/A CH$FORMULA: C21H26ClN3OS CH$EXACT_MASS: 403.14851 CH$SMILES: OCCN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc(Cl)3)Sc(cccc2)1 CH$IUPAC: InChI=1S/C21H26ClN3OS/c22-17-6-7-21-19(16-17)25(18-4-1-2-5-20(18)27-21)9-3-8-23-10-12-24(13-11-23)14-15-26/h1-2,4-7,16,26H,3,8-15H2
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: splash10-0006-9450000000-c13808005c7ad3a43067 PK$NUM_PEAK: 54 PK$PEAK: m/z int. rel.int. 41 15.9 159 42 99.99 999 43 20.9 209 44 1.39 14 45 10.9 109 54 4.9 49 55 14.9 149 56 3.69 37 57 14.9 149 58 14.9 149 69 5.9 59 70 4.99 50 71 7.9 79 73 4.9 49 74 4.9 49 82 0.59 6 83 4.9 49 84 9.9 99 96 4.9 49 97 0.99 10 98 17.9 179 99 6.9 69 100 20.9 209 111 0.99 10 113 17.9 179 125 7.9 79 139 6.9 69 141 0.59 6 143 36.9 369 153 7.9 79 157 11.9 119 171 1.69 17 188 5.9 59 196 10.9 109 197 10.9 109 198 0.59 6 200 3.9 39 210 4.9 49 211 5.9 59 212 0.39 4 213 4.9 49 214 28.9 289 215 5.9 59 232 5.99 60 233 12.9 129 246 66.9 669 247 8.9 89 259 0.39 4 260 2.9 29 272 3.9 39 273 3.9 39 372 0.49 5 385 1.9 19 403 9.9 99 //