| SpectraBase Spectrum ID |
cyV2AOnNWW |
| Name |
(1R,2S)-3-Ethenyl-4-methylcyclopent-3-ene-1,2-dicarboxylic acid diethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
252.136159120 u |
| Formula |
C14H20O4 |
| InChI |
InChI=1S/C14H20O4/c1-5-10-9(4)8-11(13(15)17-6-2)12(10)14(16)18-7-3/h5,11-12H,1,6-8H2,2-4H3/t11-,12-/m1/s1 |
| InChIKey |
GWJNQYGYAQMVFM-VXGBXAGGSA-N |
| Molecular Weight |
252.310 g/mol |
| SMILES |
[C@]1([C@@](C(C=C)=C(C1)C)(C(=O)OCC)[H])(C(=O)OCC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971238 |
