| SpectraBase Spectrum ID |
1Lxb4zg2Fkk |
| Name |
2-Ethyl-4-(1-methylene-propyl)-cyclohex-1-ene-1,4-dicarboxylic acid dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
280.167459249 u |
| Formula |
C16H24O4 |
| InChI |
InChI=1S/C16H24O4/c1-6-11(3)16(15(18)20-5)9-8-13(14(17)19-4)12(7-2)10-16/h3,6-10H2,1-2,4-5H3 |
| InChIKey |
DVXUOVXYWQWQAV-UHFFFAOYSA-N |
| SMILES |
C1(CC(CC)=C(CC1)C(=O)OC)(C(=O)OC)C(=C)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.837065 |
