| SpectraBase Spectrum ID |
49Kb6xGvfvV |
| Name |
5H-Benz[E]indeno[1,2-B]oxepin-11-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
248.083729624 u |
| Formula |
C17H12O2 |
| InChI |
InChI=1S/C17H12O2/c18-16-13-7-3-4-8-14(13)17-15(16)9-11-5-1-2-6-12(11)10-19-17/h1-8,10-11H,9H2 |
| InChIKey |
CMTFDGUKBMVEPZ-UHFFFAOYSA-N |
| Molecular Weight |
248.281 g/mol |
| SMILES |
C12=C(OC=C3C(C2)C=CC=C3)C=2C=CC=CC2C1=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.835382 |
![5H-Benz[e]indeno[1,2-b]oxepin-11-one](/api/spectrum/49Kb6xGvfvV/structure.png?h=300&w=458 "5H-Benz[e]indeno[1,2-b]oxepin-11-one")
