For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(E)-3,4-Bis{[(tert-butyl)dimethylsilyloxy]methyl}-1-(4-nitrophenyl)-6-(trimethylsilyl)hex-3-ene-1,5-diyne

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(E)-3,4-Bis{[(tert-butyl)dimethylsilyloxy]methyl}-1-(4-nitrophenyl)-6-(trimethylsilyl)hex-3-ene-1,5-diyne
SpectraBase Compound ID 8FrwxwNJlGF
InChI InChI=1S/C29H47NO4Si3/c1-28(2,3)36(10,11)33-22-25(17-14-24-15-18-27(19-16-24)30(31)32)26(20-21-35(7,8)9)23-34-37(12,13)29(4,5)6/h15-16,18-19H,22-23H2,1-13H3/b26-25+
InChIKey NZMNXQHJKXIVMI-OCEACIFDSA-N
Mol Weight 558.0 g/mol
Molecular Formula C29H47NO4Si3
Exact Mass 557.281289 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID LoPCrVWWDMy
Name (E)-3,4-bis{[(Tert-butyl)dimethylsilyloxy]methyl}-1-(4-nitrophenyl)-6-(trimethylsilyl)hex-3-ene-1,5-diyne
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 557.281288598 u
Formula C29H47NO4Si3
InChI InChI=1S/C29H47NO4Si3/c1-28(2,3)36(10,11)33-22-25(17-14-24-15-18-27(19-16-24)30(31)32)26(20-21-35(7,8)9)23-34-37(12,13)29(4,5)6/h15-16,18-19H,22-23H2,1-13H3/b26-25+
InChIKey NZMNXQHJKXIVMI-OCEACIFDSA-N
Molecular Weight 557.953 g/mol
SMILES C1(N(=O)=O)=CC=C(C#C\C(=C\(C#C[Si](C)(C)C)CO[Si](C(C)(C)C)(C)C)CO[Si](C(C)(C)C)(C)C)C=C1