| SpectraBase Spectrum ID |
8QN4UtCWQoh |
| Name |
11H-Dibenzo[B,E][1,4]dioxepin-4-carboxaldehyde, 2,7-dichloro-3-hydroxy-8-methoxy-1,6-dimethyl-11-oxo- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.001093500 u |
| Formula |
C17H12Cl2O6 |
| InChI |
InChI=1S/C17H12Cl2O6/c1-6-11-16(8(5-20)14(21)13(6)19)25-15-7(2)12(18)9(23-3)4-10(15)24-17(11)22/h4-5,21H,1-3H3 |
| InChIKey |
HZFIZEFIKOIHGY-UHFFFAOYSA-N |
| Molecular Weight |
383.183 g/mol |
| SMILES |
C1=2C(=C(C=O)C(=C(C2C)Cl)O)OC2=C(C(Cl)=C(C=C2OC1=O)OC)C |
![11H-Dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde, 2,7-dichloro-3-hydroxy-8-methoxy-1,6-dimethyl-11-oxo-](/api/spectrum/8QN4UtCWQoh/structure.png?h=300&w=458 "11H-Dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde, 2,7-dichloro-3-hydroxy-8-methoxy-1,6-dimethyl-11-oxo-")
