| SpectraBase Spectrum ID |
IejrWTbdnwt |
| Name |
(-)-1-(but-1-enyl)-5-ethoxycarbonylpyrrolidin-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
211.120843408 u |
| Formula |
C11H17NO3 |
| InChI |
InChI=1S/C11H17NO3/c1-3-5-8-12-9(6-7-10(12)13)11(14)15-4-2/h5,8-9H,3-4,6-7H2,1-2H3/b8-5+ |
| InChIKey |
QEMHEUATNMUHPM-VMPITWQZSA-N |
| Molecular Weight |
211.261 g/mol |
| SMILES |
C1(N(C(CC1)C(=O)OCC)\C=C\CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923203 |
