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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005773

ETHOPROPAZINE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005773
RECORD_TITLE: ETHOPROPAZINE; 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$NAME: ETHOPROPAZINE
CH$NAME: 10-(2-DIETHYLAMINOPROPYL)PHENOTHIAZINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C19H24N2S
CH$EXACT_MASS: 312.16602
CH$SMILES: CCN(CC)C(C)CN(c21)c(c3)c(ccc3)Sc(cccc2)1
CH$IUPAC: InChI=1S/C19H24N2S/c1-4-20(5-2)15(3)14-21-16-10-6-8-12-18(16)22-19-13-9-7-11-17(19)21/h6-13,15H,4-5,14H2,1-3H3
CH$LINK: CAS 522-00-9
CH$LINK: INCHIKEY CDOZDBSBBXSXLB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2023018

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$SPLASH: splash10-0udi-1900000000-31728da531ce58ffd47f
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  56 5.13 51
  70 2.82 28
  71 1.22 12
  72 5.76 58
  77 1.14 11
  84 3.71 37
  98 1.31 13
  99 3.74 37
  100 99.99 999
  101 7.16 72
  127 1.07 11
  139 1.19 12
  154 2.57 26
  166 2.87 29
  167 4.76 48
  171 1.01 10
  180 3.17 32
  197 1.12 11
  198 8.42 84
  199 12.51 125
  200 2.47 25
  212 1.5 15
  213 4.38 44
  312 1.56 16
//

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