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1-(4-Cl-5-([tmset-N-me-carbamato]-3-anisyl)-2,10,12-trime-7,7-di(ethylthio)-9-eeo-11,12-epoxy-13-(tmm-siloxy)-2,4-tride
SpectraBase Compound ID KF58kCt6dj1
InChI InChI=1S/C44H78ClNO8S2Si2/c1-18-50-33(6)53-37(32(5)40-43(10,54-40)30-52-58(16,17)42(7,8)9)29-44(55-19-2,56-20-3)38(47)23-21-22-31(4)26-34-27-35(39(45)36(28-34)49-12)46(11)41(48)51-24-25-57(13,14)15/h21-23,27-28,32-33,37-38,40,47H,18-20,24-26,29-30H2,1-17H3/b23-21+,31-22+
InChIKey XRZGAHOCPIOKPM-HGOSWHLPSA-N
Mol Weight 904.8 g/mol
Molecular Formula C44H78ClNO8S2Si2
Exact Mass 903.439592 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BpbHGp0FFEs
Name 1-(4-Cl-5-([tmset-N-me-carbamato]-3-anisyl)-2,10,12-trime-7,7-di(ethylthio)-9-eeo-11,12-epoxy-13-(tmm-siloxy)-2,4-tride
CAS Registry Number 86046-99-3
Comments TMSET:2-TRIMETHYLSILYL-ETHYL,ME:METHYL,EEO:1-ETHOXY-ETHOXY, TMM:T-BUTYL-DIMETHYL,CL:CHLORO,TRIME:TRIMETHYL
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C44H78ClNO8S2Si2
InChI InChI=1S/C44H78ClNO8S2Si2/c1-18-50-33(6)53-37(32(5)40-43(10,54-40)30-52-58(16,17)42(7,8)9)29-44(55-19-2,56-20-3)38(47)23-21-22-31(4)26-34-27-35(39(45)36(28-34)49-12)46(11)41(48)51-24-25-57(13,14)15/h21-23,27-28,32-33,37-38,40,47H,18-20,24-26,29-30H2,1-17H3/b23-21+,31-22+
InChIKey XRZGAHOCPIOKPM-HGOSWHLPSA-N
Literature Reference A.I. Meyers, K.A. Babiak, A.L. Campbell, J. Am. Chem. Soc. 105, 5015 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3