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2-trimethylsilylethyl (2R,3R,5R)-5-[(4S,5R)-5-(2-iodovinyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-methyl-tetrahydrofuran-2-carboxylate
SpectraBase Compound ID JvuNGWUkLYt
InChI InChI=1S/C18H31IO5Si/c1-12-11-14(16-13(7-8-19)23-18(2,3)24-16)22-15(12)17(20)21-9-10-25(4,5)6/h7-8,12-16H,9-11H2,1-6H3/t12-,13-,14-,15-,16-/m1/s1
InChIKey FDFZTFZBPWVIEY-OXGONZEZSA-N
Mol Weight 482.43 g/mol
Molecular Formula C18H31IO5Si
Exact Mass 482.098546 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zPtc1hzaS
Name 2-trimethylsilylethyl (2R,3R,5R)-5-[(4S,5R)-5-(2-iodovinyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-methyl-tetrahydrofuran-2-carboxylate
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 482.098545628 u
Formula C18H31IO5Si
InChI InChI=1S/C18H31IO5Si/c1-12-11-14(16-13(7-8-19)23-18(2,3)24-16)22-15(12)17(20)21-9-10-25(4,5)6/h7-8,12-16H,9-11H2,1-6H3/t12-,13-,14-,15-,16-/m1/s1
InChIKey FDFZTFZBPWVIEY-OXGONZEZSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/anie.201808937
Molecular Weight 482.430 g/mol
Optical Rotation [a]D 20 = -56.3 (c = 1.57, CHCl3)
Quality 117
Reported Formula C18H31O5ISi
SMILES [C@]1([C@@](C[C@@](O1)([C@]1([C@](OC(O1)(C)C)(C=CI)[H])[H])[H])(C)[H])(C(=O)OCC[Si](C)(C)C)[H]
SPLASH splash10-00di-9780100000-c9ecbf6d0293b726daac
Source of Spectrum ACI-57-SM16-25 (DOI: 10.1002/anie.201808937)
Wiley ID 1893502