| SpectraBase Spectrum ID |
G0T6W5vng7r |
| Name |
(8-Hydroxy-2H-1-benzopyran-3-yl)-(4-morpholinyl)methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.100107963 u |
| Formula |
C14H15NO4 |
| InChI |
InChI=1S/C14H15NO4/c16-12-3-1-2-10-8-11(9-19-13(10)12)14(17)15-4-6-18-7-5-15/h1-3,8,16H,4-7,9H2 |
| InChIKey |
PLTXSJGTXCGHLJ-UHFFFAOYSA-N |
| Molecular Weight |
261.277 g/mol |
| SMILES |
C1C(=CC=2C=CC=C(C2O1)O)C(=O)N1CCOCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948968 |
