| SpectraBase Spectrum ID |
65IX4yPKqxB |
| Name |
3-Hydroxy-9A-morpholino-(hexahydro)-benzo[B]cyclohepta[D]furan-9-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
303.147058156 u |
| Formula |
C17H21NO4 |
| InChI |
InChI=1S/C17H21NO4/c19-12-5-6-15-13(11-12)14-3-1-2-4-16(20)17(14,22-15)18-7-9-21-10-8-18/h5-6,11,14,19H,1-4,7-10H2 |
| InChIKey |
LZZIFXKZVIMUMQ-UHFFFAOYSA-N |
| SMILES |
C12(OC3=CC=C(C=C3C2CCCCC1=O)O)N1CCOCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.856876 |
![3-Hydroxy-9a-morpholino-(hexahydro)-benzo[b]cyclohepta[d]furan-9-one](/api/spectrum/65IX4yPKqxB/structure.png?h=300&w=458 "3-Hydroxy-9a-morpholino-(hexahydro)-benzo[b]cyclohepta[d]furan-9-one")
