| SpectraBase Spectrum ID |
BnmV81GVoGi |
| Name |
6-(Benzyloxy)-2,3-dimethoxydibenzoxepine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
360.136159120 u |
| Formula |
C23H20O4 |
| InChI |
InChI=1S/C23H20O4/c1-24-21-13-19-18-11-7-6-10-17(18)12-23(27-20(19)14-22(21)25-2)26-15-16-8-4-3-5-9-16/h3-14H,15H2,1-2H3 |
| InChIKey |
XQOGHNRWTRQAMS-UHFFFAOYSA-N |
| Molecular Weight |
360.409 g/mol |
| SMILES |
C1=2C(C=3C(=CC=CC3)C=C(O1)OCC=1C=CC=CC1)=CC(=C(C2)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.876304 |
