| SpectraBase Compound ID | 8nkag9ADUBF |
|---|---|
| InChI | InChI=1S/C12H18O4/c1-3-8-16-12(14)10-7-5-4-6-9(10)11(13)15-2/h4-5,9-10H,3,6-8H2,1-2H3 |
| InChIKey | XWYDMARBSRSROE-UHFFFAOYSA-N |
| Mol Weight | 226.27 g/mol |
| Molecular Formula | C12H18O4 |
| Exact Mass | 226.120509 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KnSddTmV7on |
|---|---|
| Name | cis-Cyclohex-4-en-1,2-dicarboxylic acid, propyl methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H18O4 |
| InChI | InChI=1S/C12H18O4/c1-3-8-16-12(14)10-7-5-4-6-9(10)11(13)15-2/h4-5,9-10H,3,6-8H2,1-2H3 |
| InChIKey | XWYDMARBSRSROE-UHFFFAOYSA-N |
| Molecular Weight | 226.272 g/mol |
| SMILES | C1C(C(CC=C1)C(OC)=O)C(OCCC)=O |
| SPLASH | splash10-004i-9400000000-436fea0fbaf9e8e54a93 |
| Source of Spectrum | TIPS-2023-856-0 |
| Wiley ID | 1885562 |