| SpectraBase Spectrum ID |
Kar1kalH3cF |
| Name |
Ethyl 2-amino-4-{5-[(3-bromophenoxy)methyl]-2-furyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
515.094350555 u |
| Formula |
C25H26BrNO6 |
| InChI |
InChI=1S/C25H26BrNO6/c1-4-30-24(29)22-21(20-17(28)11-25(2,3)12-19(20)33-23(22)27)18-9-8-16(32-18)13-31-15-7-5-6-14(26)10-15/h5-10,21H,4,11-13,27H2,1-3H3 |
| InChIKey |
UPBMLFYUOLYEQL-UHFFFAOYSA-N |
| Molecular Weight |
516.388 g/mol |
| SMILES |
NC1=C(C(C2=C(CC(CC2=O)(C)C)O1)C=1OC(COC=2C=C(Br)C=CC2)=CC1)C(=O)OCC |
![ethyl 2-amino-4-{5-[(3-bromophenoxy)methyl]-2-furyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate](/api/spectrum/Kar1kalH3cF/structure.png?h=300&w=458 "ethyl 2-amino-4-{5-[(3-bromophenoxy)methyl]-2-furyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate")
