| SpectraBase Spectrum ID |
915PAl2cvQB |
| Name |
5,9-Diisopropyl-(octahydro)-2,12-dimethyl-2,6 : 8,12-dimethano-2H,8H-benzo[1,2-B : 4,5-B']bisoxocin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.287180462 u |
| Formula |
C26H38O2 |
| InChI |
InChI=1S/C26H38O2/c1-15(2)17-7-9-25(5)13-21(17)19-11-20-22-14-26(6,10-8-18(22)16(3)4)28-24(20)12-23(19)27-25/h11-12,15-18,21-22H,7-10,13-14H2,1-6H3 |
| InChIKey |
CMKNEBDMQUVPQM-UHFFFAOYSA-N |
| Molecular Weight |
382.588 g/mol |
| SMILES |
C1=2C3C(CCC(OC2C=C2C(=C1)C1C(CCC(O2)(C)C1)C(C)C)(C)C3)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94111 |
![5,9-Diisopropyl-(octahydro)-2,12-dimethyl-2,6 : 8,12-dimethano-2H,8H-benzo[1,2-b : 4,5-b']bisoxocin](/api/spectrum/915PAl2cvQB/structure.png?h=300&w=458 "5,9-Diisopropyl-(octahydro)-2,12-dimethyl-2,6 : 8,12-dimethano-2H,8H-benzo[1,2-b : 4,5-b']bisoxocin")
