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

*Links on SpectraBase are not permalinks.

BYBIWRQDNNEQIV-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

BYBIWRQDNNEQIV-UHFFFAOYSA-N
SpectraBase Compound ID 7Hx3KNZ0pjT
InChI InChI=1S/C45H40S2/c1-3-11-29(12-4-1)33-25-43(46-27-33)31-19-21-37-38-22-20-32(44-26-34(28-47-44)30-13-5-2-6-14-30)24-42(38)45(41(37)23-31)39-17-9-7-15-35(39)36-16-8-10-18-40(36)45/h7-10,15-30H,1-6,11-14H2
InChIKey BYBIWRQDNNEQIV-UHFFFAOYSA-N
Mol Weight 644.9 g/mol
Molecular Formula C45H40S2
Exact Mass 644.257144 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 6FKc2NnEZgV
Name BYBIWRQDNNEQIV-UHFFFAOYSA-N
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H40S2
InChI InChI=1S/C45H40S2/c1-3-11-29(12-4-1)33-25-43(46-27-33)31-19-21-37-38-22-20-32(44-26-34(28-47-44)30-13-5-2-6-14-30)24-42(38)45(41(37)23-31)39-17-9-7-15-35(39)36-16-8-10-18-40(36)45/h7-10,15-30H,1-6,11-14H2
InChIKey BYBIWRQDNNEQIV-UHFFFAOYSA-N
Literature Reference Author J.PEI,J.NI,X.H.ZHOU,X.Y.CAO,Y.H.LAI
Literature Reference Citation J.ORG.CHEM.,67,8104(2002)
Literature Reference DOI 10.1021/jo020397k
Molecular Weight 644.933 g/mol
Solvent Unknown
Source File Reference UWMS24056