| SpectraBase Compound ID | Kw0jJdq6S5j |
|---|---|
| InChI | InChI=1S/C8H12O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3-4H,5-6H2,1-2H3 |
| InChIKey | CPSQPCGPYWRIPB-UHFFFAOYSA-N |
| Mol Weight | 172.18 g/mol |
| Molecular Formula | C8H12O4 |
| Exact Mass | 172.073559 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9KIYCLrdCa0 |
|---|---|
| Name | trans-2-butene-1,4-dicarboxylic acid dimethyl ester |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H12O4 |
| InChI | InChI=1S/C8H12O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3-4H,5-6H2,1-2H3 |
| InChIKey | CPSQPCGPYWRIPB-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 172.180 g/mol |
| SMILES | COC(=O)CC=CCC(=O)OC |
| SPLASH | splash10-0a4l-9600000000-7c65ebd15ba010c32b84 |
| Source of Spectrum | SRH-2022-2176-0 |
| Wiley ID | 1824539 |