| SpectraBase Spectrum ID |
5TpYB1ubxax |
| Name |
N-[2-(1-Adamantyloxy)ethyl]-N-[2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl]acetamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
468.262422262 u |
| Formula |
C27H36N2O5 |
| InChI |
InChI=1S/C27H36N2O5/c1-3-9-33-23-6-4-22(5-7-23)29-25(31)14-24(26(29)32)28(18(2)30)8-10-34-27-15-19-11-20(16-27)13-21(12-19)17-27/h4-7,19-21,24H,3,8-17H2,1-2H3 |
| InChIKey |
BAXABKWRVVJNBD-UHFFFAOYSA-N |
| Molecular Weight |
468.594 g/mol |
| SMILES |
CCCOC1=CC=C(N2C(C(N(C(=O)C)CCOC34CC5CC(C4)CC(C3)C5)CC2=O)=O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.905143 |
![N-[2-(1-adamantyloxy)ethyl]-N-[2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl]acetamide](/api/spectrum/5TpYB1ubxax/structure.png?h=300&w=458 "N-[2-(1-adamantyloxy)ethyl]-N-[2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl]acetamide")
