SpectraBase Spectrum ID |
55Y7DruoKFO |
Name |
4H-Furo[3,2-B]pyrrole-4-acetic acid, 2,5,6,6A-tetrahydro-2,5-dioxo-, ethyl ester, (R)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
225.063722453 u |
Formula |
C10H11NO5 |
InChI |
InChI=1S/C10H11NO5/c1-2-15-10(14)5-11-6-3-9(13)16-7(6)4-8(11)12/h3,7H,2,4-5H2,1H3/t7-/m1/s1 |
InChIKey |
HQFKZUBHMGFUOS-SSDOTTSWSA-N |
Molecular Weight |
225.200 g/mol |
SMILES |
C1=2N(C(C[C@]1(OC(C2)=O)[H])=O)CC(=O)OCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.976853 |