| SpectraBase Spectrum ID |
K669BBe0Kqs |
| Name |
Ethyl 2-{[(3,5-dimethyladamantan-1-yl)carbamoyl]amino}acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
308.209992767 u |
| Formula |
C17H28N2O3 |
| InChI |
InChI=1S/C17H28N2O3/c1-4-22-13(20)8-18-14(21)19-17-7-12-5-15(2,10-17)9-16(3,6-12)11-17/h12H,4-11H2,1-3H3,(H2,18,19,21)/t12-,15+,16-,17- |
| InChIKey |
BBWIGYCZVOSKPT-SPPCSIHOSA-N |
| Molecular Weight |
308.422 g/mol |
| SMILES |
C1[C@]2(C[C@]3(C[C@]1(C[C@](C2)(C3)C)C)[H])NC(NCC(OCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933242 |
![Ethyl 2-{[(3,5-dimethyladamantan-1-yl)carbamoyl]amino}acetate](/api/spectrum/K669BBe0Kqs/structure.png?h=300&w=458 "Ethyl 2-{[(3,5-dimethyladamantan-1-yl)carbamoyl]amino}acetate")
