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Reproterol, O,O',O''-tris-TMS
SpectraBase Compound ID DTLENbaMB9w
InChI InChI=1S/C27H47N5O5Si3/c1-30-25-24(26(33)31(2)27(30)34)32(19-29-25)14-12-13-28-18-23(37-40(9,10)11)20-15-21(35-38(3,4)5)17-22(16-20)36-39(6,7)8/h15-17,19,23,28H,12-14,18H2,1-11H3
InChIKey WGKKMAGNAKVTEX-UHFFFAOYSA-N
Mol Weight 606.0 g/mol
Molecular Formula C27H47N5O5Si3
Exact Mass 605.288499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6kDBrT3haMs
Name Reproterol, O,O',O''-tris-TMS
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 605.288499233 u
Formula C27H47N5O5Si3
InChI InChI=1S/C27H47N5O5Si3/c1-30-25-24(26(33)31(2)27(30)34)32(19-29-25)14-12-13-28-18-23(37-40(9,10)11)20-15-21(35-38(3,4)5)17-22(16-20)36-39(6,7)8/h15-17,19,23,28H,12-14,18H2,1-11H3
InChIKey WGKKMAGNAKVTEX-UHFFFAOYSA-N
Molecular Weight 605.958 g/mol
Nominal Mass 605 u
Number of Peaks 44
SMILES N(CCC[n]1c2c(nc1)N(C(N(C2=O)C)=O)C)CC(O[Si](C)(C)C)c1cc(cc(c1)O[Si](C)(C)C)O[Si](C)(C)C
SPLASH splash10-0zfr-1095000000-393f5fcd33f95df6a6ea
Source File Reference DSHS_50_1197
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Wiley ID 50_1197