| SpectraBase Compound ID | 8zDpSHamEFR |
|---|---|
| InChI | InChI=1S/C8H12O4/c1-6(8(10)12-3)4-5-7(9)11-2/h4-6H,1-3H3/b5-4+ |
| InChIKey | WOXXEBQDZIBOSP-SNAWJCMRSA-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 | 7QmrAVn3Kct |
|---|---|
| Name | 2-PENTENEDIOIC ACID, 4-METHYL-, DIMETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H12O4 |
| InChI | InChI=1S/C8H12O4/c1-6(8(10)12-3)4-5-7(9)11-2/h4-6H,1-3H3/b5-4+ |
| InChIKey | WOXXEBQDZIBOSP-SNAWJCMRSA-N |
| Instrument Name | CH7 |
| Molecular Weight | 172.0732 |
| SMILES | COC(C(\C=C\C(OC)=O)C)=O |
| SPLASH | splash10-08gr-9300000000-a9cc2bd3e8dea5dec21c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |