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

*Links on SpectraBase are not permalinks.

(E)-[2-(p-Methylthiophenyl)ethenyl]dimesitylborane

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

(E)-[2-(p-Methylthiophenyl)ethenyl]dimesitylborane
SpectraBase Compound ID 8TrsKlly8YQ
InChI InChI=1S/C27H31BS/c1-18-14-20(3)26(21(4)15-18)28(27-22(5)16-19(2)17-23(27)6)13-12-24-8-10-25(29-7)11-9-24/h8-17H,1-7H3/b13-12+
InChIKey VHKFOCPSTGHBMZ-OUKQBFOZSA-N
Mol Weight 398.4 g/mol
Molecular Formula C27H31BS
Exact Mass 398.223952 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 9hgG7QKwLSf
Name (E)-[2-(p-Methylthiophenyl)ethenyl]dimesitylborane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.223952342 u
Formula C27H31BS
InChI InChI=1S/C27H31BS/c1-18-14-20(3)26(21(4)15-18)28(27-22(5)16-19(2)17-23(27)6)13-12-24-8-10-25(29-7)11-9-24/h8-17H,1-7H3/b13-12+
InChIKey VHKFOCPSTGHBMZ-OUKQBFOZSA-N
Molecular Weight 398.415 g/mol
SMILES C=1(B(C=2C(C)=CC(C)=CC2C)\C=C\C=2C=CC(=CC2)SC)C(C)=CC(C)=CC1C