SpectraBase Spectrum ID |
3bI46m7CLDt |
Name |
(8-Methoxy-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 |
275.115758027 u |
Formula |
C15H17NO4 |
InChI |
InChI=1S/C15H17NO4/c1-18-13-4-2-3-11-9-12(10-20-14(11)13)15(17)16-5-7-19-8-6-16/h2-4,9H,5-8,10H2,1H3 |
InChIKey |
LPOCIUPJQGYADI-UHFFFAOYSA-N |
SMILES |
C1C(=CC=2C=CC=C(C2O1)OC)C(=O)N1CCOCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947418 |