ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006642
RECORD_TITLE: 2-(3-DIETHYLAMINOPROPIONYL)-5,7-DIMETHYL-1,2,3,4-TETRAHYDROPYRIMIDO(1,6-A)INDOLE; 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$NAME: 2-(3-DIETHYLAMINOPROPIONYL)-5,7-DIMETHYL-1,2,3,4-TETRAHYDROPYRIMIDO(1,6-A)INDOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C20H29N3O
CH$EXACT_MASS: 327.23106
CH$SMILES: CCN(CC)CCC(=O)N(C3)Cn(c(C3)1)c(c2)c(cc(C)c2)c(C)1
CH$IUPAC: InChI=1S/C20H29N3O/c1-5-21(6-2)11-10-20(24)22-12-9-18-16(4)17-13-15(3)7-8-19(17)23(18)14-22/h7-8,13H,5-6,9-12,14H2,1-4H3
CH$LINK: INCHIKEY AEWCQUKMWATSDO-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-01-SG-2
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-002r-9713000000-b23b78ac881c746cb8ad
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  58 21.4 214
  72 3.4 34
  86 99.99 999
  87 0.62 6
  101 7.5 75
  115 1.8 18
  126 2 20
  127 0.28 3
  128 3 30
  143 2.3 23
  144 1.5 15
  155 0.24 2
  156 14.1 141
  157 6.2 62
  158 11.1 111
  170 0.6 6
  171 32.7 327
  172 8.3 83
  198 4.8 48
  199 7.05 71
  200 10 100
  212 2 20
  241 7.7 77
  312 0.21 2
  326 1.3 13
  327 51 510
//
