| SpectraBase Spectrum ID |
ANToQXVV1o5 |
| Name |
Chromone, 2-[2-[5-acetoxy-3-benzyloxyphenyl]ethenyl]-3-methyl |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
426.146723803 u |
| Formula |
C27H22O5 |
| InChI |
InChI=1S/C27H22O5/c1-18-25(32-26-11-7-6-10-24(26)27(18)29)13-12-21-14-22(16-23(15-21)31-19(2)28)30-17-20-8-4-3-5-9-20/h3-16H,17H2,1-2H3/b13-12+ |
| InChIKey |
OTGHFOBWIATPHE-OUKQBFOZSA-N |
| Molecular Weight |
426.468 g/mol |
| SMILES |
C12=C(C=CC=C2)OC(=C(C1=O)C)\C=C\C1=CC(=CC(=C1)OCC1=CC=CC=C1)OC(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.941944 |
![Chromone, 2-[2-[5-acetoxy-3-benzyloxyphenyl]ethenyl]-3-methyl](/api/spectrum/ANToQXVV1o5/structure.png?h=300&w=458 "Chromone, 2-[2-[5-acetoxy-3-benzyloxyphenyl]ethenyl]-3-methyl")
