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

*Links on SpectraBase are not permalinks.
Methyl 4'-Bromo-6-cyano-3-hydroxy-4-octylbiphenyl-2-carboxylate
SpectraBase Compound ID 8gSobY7OjyE
InChI InChI=1S/C23H26BrNO3/c1-3-4-5-6-7-8-9-17-14-18(15-25)20(16-10-12-19(24)13-11-16)21(22(17)26)23(27)28-2/h10-14,26H,3-9H2,1-2H3
InChIKey XAROWFGOBFWUBL-UHFFFAOYSA-N
Mol Weight 444.37 g/mol
Molecular Formula C23H26BrNO3
Exact Mass 443.109607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 5S86e0QMXEv
Name Methyl 4'-Bromo-6-cyano-3-hydroxy-4-octylbiphenyl-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26BrNO3
InChI InChI=1S/C23H26BrNO3/c1-3-4-5-6-7-8-9-17-14-18(15-25)20(16-10-12-19(24)13-11-16)21(22(17)26)23(27)28-2/h10-14,26H,3-9H2,1-2H3
InChIKey XAROWFGOBFWUBL-UHFFFAOYSA-N
Molecular Weight 444.369 g/mol
SMILES Oc1c(c(c(C#N)cc1CCCCCCCC)-c1ccc(cc1)Br)C(=O)OC
SPLASH splash10-001i-0092200000-c75a8cb2bd00cbe61966
Source of Spectrum F4-41-1631-4w
Wiley ID 1672325