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Orciprenaline, O,O',O''-tris-TBS
SpectraBase Compound ID 3i878OYyBRZ
InChI InChI=1S/C29H59NO3Si3/c1-22(2)30-21-26(33-36(16,17)29(9,10)11)23-18-24(31-34(12,13)27(3,4)5)20-25(19-23)32-35(14,15)28(6,7)8/h18-20,22,26,30H,21H2,1-17H3
InChIKey HXHIKZACHVSCTG-UHFFFAOYSA-N
Mol Weight 554.1 g/mol
Molecular Formula C29H59NO3Si3
Exact Mass 553.380274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C6vvHBzfsUT
Name Orciprenaline, O,O',O''-tris-TBS
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 553.380274366 u
Formula C29H59NO3Si3
InChI InChI=1S/C29H59NO3Si3/c1-22(2)30-21-26(33-36(16,17)29(9,10)11)23-18-24(31-34(12,13)27(3,4)5)20-25(19-23)32-35(14,15)28(6,7)8/h18-20,22,26,30H,21H2,1-17H3
InChIKey HXHIKZACHVSCTG-UHFFFAOYSA-N
Molecular Weight 554.050 g/mol
Nominal Mass 553 u
Number of Peaks 39
SMILES N(CC(O[Si](C(C)(C)C)(C)C)c1cc(O[Si](C(C)(C)C)(C)C)cc(O[Si](C(C)(C)C)(C)C)c1)C(C)C
SPLASH splash10-001i-1000900000-47b5c37dc55ba966f218
Source File Reference DSHS_50_0920
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Wiley ID 50_920