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

*Links on SpectraBase are not permalinks.
4-Isopropyl-2-(3',8'-dimethoxy-2',2''-binaphthalen-1'-yl)-4,5-dihydrooxazole
SpectraBase Compound ID EanQnXQ95h8
InChI InChI=1S/C28H27NO3/c1-17(2)22-16-32-28(29-22)27-25-20(10-7-11-23(25)30-3)15-24(31-4)26(27)21-13-12-18-8-5-6-9-19(18)14-21/h5-15,17,22H,16H2,1-4H3
InChIKey NECDWJPUTHIJCF-UHFFFAOYSA-N
Mol Weight 425.53 g/mol
Molecular Formula C28H27NO3
Exact Mass 425.199094 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 Cim8CROgWdk
Name 4-Isopropyl-2-(3',8'-dimethoxy-2',2''-binaphthalen-1'-yl)-4,5-dihydrooxazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 425.199093730 u
Formula C28H27NO3
InChI InChI=1S/C28H27NO3/c1-17(2)22-16-32-28(29-22)27-25-20(10-7-11-23(25)30-3)15-24(31-4)26(27)21-13-12-18-8-5-6-9-19(18)14-21/h5-15,17,22H,16H2,1-4H3
InChIKey NECDWJPUTHIJCF-UHFFFAOYSA-N
Molecular Weight 425.528 g/mol
SMILES C1(C2=C(C3=CC=4C=CC=CC4C=C3)C(OC)=CC3=C2C(OC)=CC=C3)=NC(C(C)C)CO1