ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003074
RECORD_TITLE: CYCLIZINE; 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$NAME: CYCLIZINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₈H₂₂N₂
CH$EXACT_MASS: 266.17830
CH$SMILES: CN(C3)CCN(C3)C(c(c2)cccc2)c(c1)cccc1
CH$IUPAC: InChI=1S/C18H22N2/c1-19-12-14-20(15-13-19)18(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18H,12-15H2,1H3
CH$LINK: INCHIKEY UVKZSORBKUEBAZ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4022864

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$SPLASH: splash10-0aos-9620000000-ed8810ea85a4b69f8507
PK$NUM_PEAK: 58
PK$PEAK: m/z int. rel.int.
  54 2.9 29
  55 5.9 59
  56 66.4 664
  57 0.94 9
  58 17.9 179
  59 0.9 9
  70 19.4 194
  71 0.64 6
  72 10.9 109
  77 3.9 39
  82 3.4 34
  83 0.34 3
  84 2.9 29
  85 6.9 69
  89 3.9 39
  90 0.24 2
  91 12.9 129
  95 1.4 14
  96 1.4 14
  97 0.79 8
  98 3.9 39
  99 99.99 999
  100 10.9 109
  103 0.19 2
  104 4.9 49
  151 1.9 19
  152 19.4 194
  153 0.54 5
  164 2.9 29
  165 37.9 379
  166 13.9 139
  167 6.04 60
  168 25.4 254
  169 2.9 29
  178 0.9 9
  179 0.19 2
  180 2.9 29
  181 0.4 4
  182 1.4 14
  189 1.09 11
  190 1.4 14
  193 3.9 39
  194 43.4 434
  195 3.59 36
  196 6.9 69
  205 1.9 19
  206 11.9 119
  207 3.59 36
  208 27.9 279
  209 5.9 59
  210 1.9 19
  222 0.39 4
  223 1.4 14
  251 1.9 19
  265 1.9 19
  266 4.34 43
  267 8.9 89
  268 1.4 14
//