| SpectraBase Spectrum ID |
B6ZJokGLHm5 |
| Name |
2-[(1R,4S)-4-Hydroxy-1-cyclopent-2-enyl]propanedioic acid dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
214.084123546 u |
| Formula |
C10H14O5 |
| InChI |
InChI=1S/C10H14O5/c1-14-9(12)8(10(13)15-2)6-3-4-7(11)5-6/h3-4,6-8,11H,5H2,1-2H3/t6-,7+/m0/s1 |
| InChIKey |
PWSYHNSLZSFQKV-NKWVEPMBSA-N |
| Molecular Weight |
214.217 g/mol |
| SMILES |
C([C@]1(C=C[C@](C1)(O)[H])[H])(C(=O)OC)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944698 |
![2-[(1R,4S)-4-hydroxy-1-cyclopent-2-enyl]propanedioic acid dimethyl ester](/api/spectrum/B6ZJokGLHm5/structure.png?h=300&w=458 "2-[(1R,4S)-4-hydroxy-1-cyclopent-2-enyl]propanedioic acid dimethyl ester")
