| SpectraBase Spectrum ID |
79x9IXp4TRj |
| Name |
4H-Furo[3,2-B]pyrrole-4-acetic acid, hexahydro-3-methylene-2,5-dioxo-, ethyl ester, cis- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
239.079372518 u |
| Formula |
C11H13NO5 |
| InChI |
InChI=1S/C11H13NO5/c1-3-16-9(14)5-12-8(13)4-7-10(12)6(2)11(15)17-7/h7,10H,2-5H2,1H3/t7-,10-/m1/s1 |
| InChIKey |
RPUPDBGEYCRWNI-GMSGAONNSA-N |
| Molecular Weight |
239.227 g/mol |
| SMILES |
[C@@]12(N(C(C[C@]1(OC(C2=C)=O)[H])=O)CC(=O)OCC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.841323 |
![4H-Furo[3,2-b]pyrrole-4-acetic acid, hexahydro-3-methylene-2,5-dioxo-, ethyl ester, cis-](/api/spectrum/79x9IXp4TRj/structure.png?h=300&w=458 "4H-Furo[3,2-b]pyrrole-4-acetic acid, hexahydro-3-methylene-2,5-dioxo-, ethyl ester, cis-")
