ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005769
RECORD_TITLE: PERAZINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAMAMATSU UNIV. SCHOOL OF MEDICINE
LICENSE: CC BY-NC-SA

CH$NAME: PERAZINE
CH$NAME: 10-(3-(4-METHYL-1-PIPERAZINYL)PROPYL)-10H-PHENOTHIAZINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₀H₂₅N₃S
CH$EXACT_MASS: 339.17692
CH$SMILES: CN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc3)Sc(cccc2)1
CH$IUPAC: InChI=1S/C20H25N3S/c1-21-13-15-22(16-14-21)11-6-12-23-17-7-2-4-9-19(17)24-20-10-5-3-8-18(20)23/h2-5,7-10H,6,11-16H2,1H3
CH$LINK: CAS 84-97-9
CH$LINK: INCHIKEY WEYVCQFUGFRXOM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6048628

AC$INSTRUMENT: JEOL JMS-D-300
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-01w4-3932000000-826fc2cac2d9f88605f2
PK$NUM_PEAK: 108
PK$PEAK: m/z int. rel.int.
  51 2.3 23
  52 3.62 36
  56 8.48 85
  57 1.64 16
  58 15.15 152
  59 1.72 17
  62 1.31 13
  63 2.22 22
  65 2.47 25
  69 2.47 25
  70 89.62 896
  71 13.17 132
  72 4.2 42
  75 2.22 22
  77 3.29 33
  78 1.72 17
  80 1.48 15
  82 1.97 20
  83 3.45 35
  84 5.6 56
  85 6.5 65
  86 1.97 20
  88 1.56 16
  89 1.31 13
  93 2.22 22
  96 3.87 39
  97 4.94 49
  98 3.54 35
  99 7.41 74
  100 4.44 44
  101 2.14 21
  105 1.81 18
  106 1.56 16
  108 2.14 21
  111 8.56 86
  112 4.2 42
  113 87.31 873
  114 9.55 96
  115 2.05 21
  117 1.31 13
  125 2.05 21
  126 2.47 25
  127 15.73 157
  128 3.37 34
  130 1.31 13
  135 2.55 26
  136 1.72 17
  138 1.56 16
  139 6.83 68
  140 4.85 49
  141 54.11 541
  142 5.93 59
  148 1.31 13
  151 1.31 13
  152 4.36 44
  153 3.37 34
  154 11.12 111
  155 3.04 30
  165 1.56 16
  166 10.87 109
  167 21.91 219
  168 3.62 36
  170 1.48 15
  171 4.2 42
  172 1.97 20
  178 1.97 20
  179 5.6 56
  180 23.39 234
  181 4.44 44
  184 2.14 21
  191 1.56 16
  192 1.64 16
  193 1.72 17
  196 2.96 30
  197 5.18 52
  198 38.22 382
  199 67.29 673
  200 9.96 100
  201 3.87 39
  205 1.4 14
  206 1.64 16
  207 1.31 13
  210 3.45 35
  211 1.56 16
  212 18.61 186
  213 14.9 149
  214 3.62 36
  223 5.93 59
  224 16.39 164
  225 17.95 180
  226 13.34 133
  227 3.04 30
  236 4.85 49
  237 2.88 29
  238 31.05 311
  239 20.09 201
  240 4.44 44
  241 2.05 21
  268 1.81 18
  269 1.31 13
  282 4.53 45
  295 4.61 46
  296 1.97 20
  337 2.22 22
  339 99.99 999
  340 25.2 252
  341 7.82 78
  342 2.05 21
//