| SpectraBase Spectrum ID |
9zuOrXtDhxc |
| Name |
cis-(+-)-hexahydro-3,4-dioxo-1H-furo[3,4-B]pyrrole-1-carboxylic acid methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
199.048072389 u |
| Formula |
C8H9NO5 |
| InChI |
InChI=1S/C8H9NO5/c1-13-8(12)9-2-5(10)6-4(9)3-14-7(6)11/h4,6H,2-3H2,1H3/t4-,6+/m1/s1 |
| InChIKey |
NFISIGDVOFRRFU-XINAWCOVSA-N |
| Molecular Weight |
199.162 g/mol |
| SMILES |
[C@]12(N(CC([C@]2(C(=O)OC1)[H])=O)C(=O)OC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.991319 |
![cis-(+-)-hexahydro-3,4-dioxo-1H-furo[3,4-b]pyrrole-1-carboxylic acid methyl ester](/api/spectrum/9zuOrXtDhxc/structure.png?h=300&w=458 "cis-(+-)-hexahydro-3,4-dioxo-1H-furo[3,4-b]pyrrole-1-carboxylic acid methyl ester")
