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Ritodrine, O,O',O''-tris-TMS
SpectraBase Compound ID HhvkOQZMtsW
InChI InChI=1S/C26H45NO3Si3/c1-21(27-20-19-22-11-15-24(16-12-22)28-31(2,3)4)26(30-33(8,9)10)23-13-17-25(18-14-23)29-32(5,6)7/h11-18,21,26-27H,19-20H2,1-10H3/t21-,26-/m1/s1
InChIKey WIDWQGAXCQQURL-QFQXNSOFSA-N
Mol Weight 503.9 g/mol
Molecular Formula C26H45NO3Si3
Exact Mass 503.270724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID aYBM2JzvRZ
Name Ritodrine, O,O',O''-tris-TMS
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 503.270723915 u
Formula C26H45NO3Si3
InChI InChI=1S/C26H45NO3Si3/c1-21(27-20-19-22-11-15-24(16-12-22)28-31(2,3)4)26(30-33(8,9)10)23-13-17-25(18-14-23)29-32(5,6)7/h11-18,21,26-27H,19-20H2,1-10H3/t21-,26-/m1/s1
InChIKey WIDWQGAXCQQURL-QFQXNSOFSA-N
Molecular Weight 503.905 g/mol
Nominal Mass 503 u
Number of Peaks 40
SMILES N(CCc1ccc(O[Si](C)(C)C)cc1)[C@@]([C@@](O[Si](C)(C)C)(c1ccc(cc1)O[Si](C)(C)C)[H])(C)[H]
SPLASH splash10-000i-1390000000-f4b05fc9dbcf72d5b668
Source File Reference DSHS_50_1225
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Wiley ID 50_1225