| SpectraBase Spectrum ID |
1RBOWYfpaXt |
| Name |
(3R*,3'R*)-(p*,p*)-trans-7,7'-dimethoxy-3,3'-dimethyl-1,1',2,2',3,3',4,4''-tetrahydrobiphenanthrenylidene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
448.240230268 u |
| Formula |
C32H32O2 |
| InChI |
InChI=1S/C32H32O2/c1-19-5-7-21-9-11-23-17-25(33-3)13-15-27(23)31(21)29(19)30-20(2)6-8-22-10-12-24-18-26(34-4)14-16-28(24)32(22)30/h9-20H,5-8H2,1-4H3/b30-29+/t19-,20-/m1/s1 |
| InChIKey |
OIJPGVMCGLYGNH-BYIGMGRBSA-N |
| Molecular Weight |
448.606 g/mol |
| SMILES |
C1=2\C(=C\3C=4C=5C(=CC(=CC5)OC)C=CC4CC[C@]3(C)[H])[C@@](CCC2C=CC=2C1=CC=C(C2)OC)(C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948123 |
