| SpectraBase Spectrum ID |
IWqVTBUmBdZ |
| Name |
2H-1-Benzopyran-2-one, 4-(1-bromopropyl)-5,7-dimethoxy-8-(1-oxobutyl)- |
| CAS Registry Number |
111249-74-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21BrO5 |
| InChI |
InChI=1S/C18H21BrO5/c1-5-7-12(20)17-14(23-4)9-13(22-3)16-10(11(19)6-2)8-15(21)24-18(16)17/h8-9,11H,5-7H2,1-4H3 |
| InChIKey |
DQCDTJQKZZDATO-UHFFFAOYSA-N |
| Molecular Weight |
397.265 g/mol |
| SMILES |
c12c(c(C(=O)CCC)c(cc2OC)OC)OC(C=C1C(Br)CC)=O |
| SPLASH |
splash10-0fi0-0096000000-c7c6e3cd1d8f0a79c16b |
| Source of Spectrum |
KC-1987-340-15 |
| Synonyms |
4-(1-bromopropyl)-8-butyryl-5,7-dimethoxy-2H-chromen-2-one
4-(1-Bromopropyl)-8-butyryl-5,7-dimethoxycoumarin |
| Wiley ID |
1367284 |
