ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011868
RECORD_TITLE: (2AR,5AS,6R)-2,4-DIPHENYL-6-TRIMETHYLSILYL-3,5-DIOXO-3,4,5,6-TETRAHYDROPYRROLO(3,4-C)PYRROLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YOSHIKI O, FAC, TECHNOLOGY, OSAKA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: (2AR,5AS,6R)-2,4-DIPHENYL-6-TRIMETHYLSILYL-3,5-DIOXO-3,4,5,6-TETRAHYDROPYRROLO(3,4-C)PYRROLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₁H₂₂N₂O₂Si
CH$EXACT_MASS: 362.14505
CH$SMILES: c(c4)ccc(c4)N(C(=O)1)C(=O)C([H])(C([H])([Si](C)(C)C)2)C([H])1C(c(c3)cccc3)=N2
CH$IUPAC: InChI=1S/C21H22N2O2Si/c1-26(2,3)19-17-16(18(22-19)14-10-6-4-7-11-14)20(24)23(21(17)25)15-12-8-5-9-13-15/h4-13,16-17,19H,1-3H3/t16-,17-,19+/m1/s1
CH$LINK: INCHIKEY NMQPRLMQDAJJKZ-LMMKCTJWSA-N

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$SPLASH: splash10-0229-9345000000-47517cee570dee2c85d6
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  73 99.99 999
  74 8.8 88
  75 4.8 48
  77 5.1 51
  89 3.3 33
  91 4 40
  105 4.3 43
  115 12.6 126
  117 13 130
  119 3.8 38
  142 7.4 74
  143 4.1 41
  200 7 70
  214 10.6 106
  215 14.5 145
  216 3.4 34
  242 12.1 121
  244 3.2 32
  290 4.4 44
  291 4.6 46
  348 4.5 45
  361 7.9 79
  362 26.7 267
  363 27.3 273
  364 9.3 93
//