| SpectraBase Spectrum ID |
BJVXXwkIYBo |
| Name |
1-(2,4-Dihydroxyphenyl)-2-(4-methoxyphenyl)-propan-1-one;angolensin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.104858991 u |
| Formula |
C16H16O4 |
| InChI |
InChI=1S/C16H16O4/c1-10(11-3-6-13(20-2)7-4-11)16(19)14-8-5-12(17)9-15(14)18/h3-10,17-18H,1-2H3 |
| InChIKey |
CCOJFDRSZSSKOG-UHFFFAOYSA-N |
| Molecular Weight |
272.300 g/mol |
| SMILES |
C1(O)=CC(O)=C(C=C1)C(=O)C(C)C1=CC=C(OC)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.934523 |
