| SpectraBase Spectrum ID |
FQ5pCJnqrut |
| Name |
Cyclopent[D][1,3]oxazin-2(1H)-one, hexahydro-4-phenyl-, (4.alpha.,4A.alpha.,7A.beta.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
217.110278725 u |
| Formula |
C13H15NO2 |
| InChI |
InChI=1S/C13H15NO2/c15-13-14-11-8-4-7-10(11)12(16-13)9-5-2-1-3-6-9/h1-3,5-6,10-12H,4,7-8H2,(H,14,15) |
| InChIKey |
XYZNYSAGIVKILN-UHFFFAOYSA-N |
| Molecular Weight |
217.268 g/mol |
| SMILES |
C1(=O)OC(C2=CC=CC=C2)C2C(N1)CCC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.860261 |
![Cyclopent[d][1,3]oxazin-2(1H)-one, hexahydro-4-phenyl-, (4.alpha.,4a.alpha.,7a.beta.)-](/api/spectrum/FQ5pCJnqrut/structure.png?h=300&w=458 "Cyclopent[d][1,3]oxazin-2(1H)-one, hexahydro-4-phenyl-, (4.alpha.,4a.alpha.,7a.beta.)-")
