| SpectraBase Spectrum ID |
7h324hQ5Nhz |
| Name |
1,4-Phenanthrenedione, 3,6,8-tris(1,1-dimethylethyl)-5-methoxy- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
406.250794952 u |
| Formula |
C27H34O3 |
| InChI |
InChI=1S/C27H34O3/c1-25(2,3)17-13-19(27(7,8)9)24(30-10)22-15(17)11-12-16-20(28)14-18(26(4,5)6)23(29)21(16)22/h11-14H,1-10H3 |
| InChIKey |
POMNRPRSCOGBLU-UHFFFAOYSA-N |
| Molecular Weight |
406.566 g/mol |
| SMILES |
C1(C=2C3=C(C(C(C)(C)C)=CC(=C3OC)C(C)(C)C)C=CC2C(C=C1C(C)(C)C)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916392 |
