ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003765
RECORD_TITLE: 2-(2,3-DITRIMETHYLSILYLOXYBUTOXY)-N-(2-(DIETHYLAMINO)ETHYL)-4-QUINOLINECARBOXAMIDE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 2-(2,3-DITRIMETHYLSILYLOXYBUTOXY)-N-(2-(DIETHYLAMINO)ETHYL)-4-QUINOLINECARBOXAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₆H₄₅N₃O₄Si₂
CH$EXACT_MASS: 519.29486
CH$SMILES: C(C(COc(n2)cc(C(=O)NCCN(CC)CC)c(c21)cccc1)O[Si](C)(C)C)(C)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C26H45N3O4Si2/c1-10-29(11-2)17-16-27-26(30)22-18-25(28-23-15-13-12-14-21(22)23)31-19-24(33-35(7,8)9)20(3)32-34(4,5)6/h12-15,18,20,24H,10-11,16-17,19H2,1-9H3,(H,27,30)
CH$LINK: INCHIKEY LUCHTGRLVSVSLX-UHFFFAOYSA-N

AC$INSTRUMENT: HITACHI M-60
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 100 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

PK$SPLASH: splash10-0079-9000050000-b6555adca0ce3781d9fa
PK$NUM_PEAK: 37
PK$PEAK: m/z int. rel.int.
  70 0.21 2
  71 0.41 4
  72 0.34 3
  73 1.28 13
  74 0.3 3
  84 0.29 3
  85 0.15 2
  86 99.99 999
  87 8.32 83
  99 3.51 35
  100 1.83 18
  103 1.12 11
  117 2.95 30
  118 0.16 2
  143 1.02 10
  145 0.15 2
  147 0.74 7
  217 0.48 5
  233 0.66 7
  250 0.49 5
  288 0.47 5
  289 0.62 6
  344 0.74 7
  360 3.11 31
  361 0.67 7
  362 0.21 2
  400 0.26 3
  402 1.32 13
  403 0.33 3
  430 0.62 6
  504 6.46 65
  505 1.24 12
  507 0.2 2
  520 50.72 507
  521 5.32 53
  522 3.74 37
  524 0.55 6
//