| SpectraBase Spectrum ID |
E1OYUv3oWrm |
| Name |
1-Benzothiepin-5-ol, 3-methoxy-4-phenyl-, acetate |
| CAS Registry Number |
70477-41-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H16O3S |
| InChI |
InChI=1S/C19H16O3S/c1-13(20)22-19-15-10-6-7-11-17(15)23-12-16(21-2)18(19)14-8-4-3-5-9-14/h3-12H,1-2H3 |
| InChIKey |
LGUDLAGTEWFHEY-UHFFFAOYSA-N |
| Molecular Weight |
324.394 g/mol |
| SMILES |
C1(=C(C(=CSc2c1cccc2)OC)c1ccccc1)OC(=O)C |
| SPLASH |
splash10-001i-0092000000-0683dc08f2a29ab9e26f |
| Source of Spectrum |
K-112-790-0 |
| Synonyms |
3-methoxy-4-phenyl-1-benzothiepin-5-yl acetate
5-Acetoxy-3-methoxy-4-phenyl-1-benzothiepin |
| Wiley ID |
1323262 |
