| SpectraBase Spectrum ID |
6BHNPndaacO |
| Name |
6-Acetoxy-1,12-methylenebenz[A]anthracen-11-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
312.078644243 u |
| Formula |
C21H12O3 |
| InChI |
InChI=1S/C21H12O3/c1-11(22)24-21-14-7-3-2-6-13(14)19-18-16(21)10-9-12-5-4-8-15(17(12)18)20(19)23/h2-10H,1H3 |
| InChIKey |
ZJCWZPRWPQYRPM-UHFFFAOYSA-N |
| Molecular Weight |
312.324 g/mol |
| SMILES |
C=12C(C3=CC=CC=4C3=C2C(C(OC(=O)C)=C2C1C=CC=C2)=CC4)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.908761 |
![6-Acetoxy-1,12-Methylenebenz[a]anthracen-11-one](/api/spectrum/6BHNPndaacO/structure.png?h=300&w=458 "6-Acetoxy-1,12-Methylenebenz[a]anthracen-11-one")
