| SpectraBase Spectrum ID |
DJxUF4b41Bz |
| Name |
2-(3-Chloro-2-keto-4-methyl-chromen-7-yl)oxyacetic acid tert-butyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
324.076451342 u |
| Formula |
C16H17ClO5 |
| InChI |
InChI=1S/C16H17ClO5/c1-9-11-6-5-10(7-12(11)21-15(19)14(9)17)20-8-13(18)22-16(2,3)4/h5-7H,8H2,1-4H3 |
| InChIKey |
XOPQFTOMVLVYFR-UHFFFAOYSA-N |
| Molecular Weight |
324.760 g/mol |
| SMILES |
C1(C(=C(C)C2=C(O1)C=C(OCC(OC(C)(C)C)=O)C=C2)Cl)=O |
