| SpectraBase Spectrum ID |
d0xHi36SGR |
| Name |
2,4-Dimethoxy-4B,5,6,7,8,8A-hexahydro-9(10H)-phenanthrone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
260.141244501 u |
| Formula |
C16H20O3 |
| InChI |
InChI=1S/C16H20O3/c1-18-11-7-10-8-14(17)12-5-3-4-6-13(12)16(10)15(9-11)19-2/h7,9,12-13H,3-6,8H2,1-2H3 |
| InChIKey |
YUQUDMLLQQVQRX-UHFFFAOYSA-N |
| Molecular Weight |
260.333 g/mol |
| SMILES |
C12CCCCC1C(CC=1C=C(C=C(C21)OC)OC)=O |
| Spectrum/Structure Validation Score (Raman) |
0.934519 |
