| SpectraBase Spectrum ID |
2lUUMTq3Dha |
| Name |
1-Benzoxepin-3-carboxylic acid, 7-formyl-2,5-dihydro-5-oxo-, methyl ester |
| Alternate Name(s) |
Methyl 7-formyl-2,5-dihydro-5-oxo-1-benzoxepine-3-carboxylate
Methyl 7-formyl-5-oxo-2,5-dihydro-1-benzoxepin-3-carboxylate |
| CAS Registry Number |
87868-83-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H10O5 |
| InChI |
InChI=1S/C13H10O5/c1-17-13(16)9-5-11(15)10-4-8(6-14)2-3-12(10)18-7-9/h2-6H,7H2,1H3 |
| InChIKey |
DXBMBZISPOIHKZ-UHFFFAOYSA-N |
| Molecular Weight |
246.218 g/mol |
| SMILES |
C1(=CC(c2cc(C=O)ccc2OC1)=O)C(=O)OC |
| SPLASH |
splash10-01p2-0690000000-dab074f659293cb5a804 |
| Source of Spectrum |
KC-1983-1720-0 |
| Wiley ID |
1248754 |
