| SpectraBase Spectrum ID |
7RNbTQwztHp |
| Name |
3-[3-(4-Chlorophenyl)-3-oxoprop-1-en-1-yl]-6-methylchromen-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
324.055321976 u |
| Formula |
C19H13ClO3 |
| InChI |
InChI=1S/C19H13ClO3/c1-12-2-9-18-16(10-12)19(22)14(11-23-18)5-8-17(21)13-3-6-15(20)7-4-13/h2-11H,1H3/b8-5+ |
| InChIKey |
MTNDIQBMIIEEKN-VMPITWQZSA-N |
| Molecular Weight |
324.763 g/mol |
| SMILES |
C1=CC(=CC2=C1OC=C(C2=O)\C=C\C(C1=CC=C(C=C1)Cl)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.952015 |
![3-[3-(4-Chlorophenyl)-3-oxoprop-1-en-1-yl]-6-methylchromen-4-one](/api/spectrum/7RNbTQwztHp/structure.png?h=300&w=458 "3-[3-(4-Chlorophenyl)-3-oxoprop-1-en-1-yl]-6-methylchromen-4-one")
