| SpectraBase Spectrum ID |
5pdon5bdUsk |
| Name |
2H-1-Benzopyran-2-one, 4-(1-bromopropyl)-5,7-dihydroxy-6-(3-methyl-1-oxobutyl)- |
| Alternate Name(s) |
4-(1-bromopropyl)-5,7-dihydroxy-6-(3-methylbutanoyl)-2H-chromen-2-one
4-(1-Bromopropyl)-5,7-dihydroxy-6-(3-methylbutyryl)coumarin |
| CAS Registry Number |
111249-67-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H19BrO5 |
| InChI |
InChI=1S/C17H19BrO5/c1-4-10(18)9-6-14(21)23-13-7-12(20)16(17(22)15(9)13)11(19)5-8(2)3/h6-8,10,20,22H,4-5H2,1-3H3 |
| InChIKey |
XVHCYJWNHLHOQX-UHFFFAOYSA-N |
| Molecular Weight |
383.238 g/mol |
| SMILES |
Oc1c(c(c2c(c1)OC(C=C2C(Br)CC)=O)O)C(CC(C)C)=O |
| SPLASH |
splash10-0f6t-0094000000-b7e6cf01025a877201b7 |
| Source of Spectrum |
KC-1987-338-12 |
| Wiley ID |
1360396 |
