| SpectraBase Spectrum ID |
3m3TG2j0IMH |
| Name |
(3as*, 8S*, 10S*, 10As*, 10BS*)-2, 3, 3A, 7, 8, 9, 10, 10A, 10B-nonahydro-5-p-tolyl-1H-phenanthro[1,10-bc]furan-10-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.193280075 u |
| Formula |
C22H26O2 |
| InChI |
InChI=1S/C22H26O2/c1-13-8-10-14(11-9-13)22-17-12-15-4-2-6-18(23)20(15)16-5-3-7-19(24-22)21(16)17/h8-12,16,18-21,23H,2-7H2,1H3/t16-,18-,19-,20+,21-/m0/s1 |
| InChIKey |
PDGIOPXAJSLGAK-BWUHRYBWSA-N |
| Molecular Weight |
322.448 g/mol |
| SMILES |
[C@@]1(O)(CCCC=2[C@@]1([C@]1([C@@]3([C@@](CCC1)([H])OC(C1=CC=C(C=C1)C)=C3C2)[H])[H])[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.954106 |
![(3aS*, 8S*, 10S*, 10aS*, 10bS*)-2, 3, 3a, 7, 8, 9, 10, 10a, 10b-nonahydro-5-p-tolyl-1H-phenanthro[1,10-bc]furan-10-ol](/api/spectrum/3m3TG2j0IMH/structure.png?h=300&w=458 "(3aS*, 8S*, 10S*, 10aS*, 10bS*)-2, 3, 3a, 7, 8, 9, 10, 10a, 10b-nonahydro-5-p-tolyl-1H-phenanthro[1,10-bc]furan-10-ol")
