| SpectraBase Spectrum ID |
1SFIqjVvwYz |
| Name |
(2S)-2-(3,4-Dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-2H-naphthalen-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.146723803 u |
| Formula |
C20H22O5 |
| InChI |
InChI=1S/C20H22O5/c1-22-16-8-6-12(9-17(16)23-2)14-7-5-13-10-18(24-3)19(25-4)11-15(13)20(14)21/h6,8-11,14H,5,7H2,1-4H3/t14-/m0/s1 |
| InChIKey |
WMPUHTIKGJAHAB-AWEZNQCLSA-N |
| Molecular Weight |
342.391 g/mol |
| SMILES |
C1(C2=C(C=C(C(=C2)OC)OC)CC[C@]1(C=1C=C(OC)C(=CC1)OC)[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960606 |
