ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003829
RECORD_TITLE: 10-(3-DIMETHYLAMINOPROPYL)-PHENOTHIAZINE; 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$NAME: 10-(3-DIMETHYLAMINOPROPYL)-PHENOTHIAZINE
CH$NAME: PROMAZINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₇H₂₀N₂S
CH$EXACT_MASS: 284.13472
CH$SMILES: CN(C)CCCN(c21)c(c3)c(ccc3)Sc(cccc2)1
CH$IUPAC: InChI=1S/C17H20N2S/c1-18(2)12-7-13-19-14-8-3-5-10-16(14)20-17-11-6-4-9-15(17)19/h3-6,8-11H,7,12-13H2,1-2H3
CH$LINK: INCHIKEY ZGUGWUXLJSTTMA-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2023517

AC$INSTRUMENT: Unknown
AC$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$SPLASH: splash10-0a4r-9230000000-62cbfd979fa705bc6b5e
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  56 1.9 19
  57 1.9 19
  58 99.99 999
  59 0.49 5
  70 3.4 34
  71 1.9 19
  72 5.9 59
  84 0.34 3
  85 12.9 129
  86 29.9 299
  149 1.9 19
  151 0.04 0
  152 1.9 19
  154 2.4 24
  180 5.9 59
  197 0.19 2
  198 11.4 114
  199 20.9 209
  200 0.2 2
  201 0.14 1
  212 6.9 69
  213 5.9 59
  214 1.4 14
  226 0.29 3
  238 23.9 239
  239 7.9 79
  240 2.4 24
  284 4.39 44
  285 10.4 104
  286 3.9 39
//