ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002765
RECORD_TITLE: PROQUAMAZINE; 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$NAME: PROQUAMAZINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₉H₂₅N₃S
CH$EXACT_MASS: 327.17692
CH$SMILES: CN(C)CC(N(C)C)CN(c21)c(c3)c(ccc3)Sc(cccc2)1
CH$IUPAC: InChI=1S/C19H25N3S/c1-20(2)13-15(21(3)4)14-22-16-9-5-7-11-18(16)23-19-12-8-6-10-17(19)22/h5-12,15H,13-14H2,1-4H3
CH$LINK: INCHIKEY YZQNFFLGIYEXMM-UHFFFAOYSA-N

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$SPLASH: splash10-052b-9800000000-ffa7b46cf6c2c8a24f4a
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  41 7.9 79
  42 10.9 109
  43 9.9 99
  55 0.99 10
  56 11.9 119
  57 9.9 99
  58 58.9 589
  70 6.19 62
  71 20.9 209
  72 11.9 119
  115 33.9 339
  154 0.39 4
  166 1.9 19
  171 0.9 9
  180 3.9 39
  198 99.99 999
  212 1.9 19
  223 0.9 9
  238 0.9 9
  269 1.19 12
  282 0.9 9
  327 2.9 29
//