| SpectraBase Compound ID | KIF8pImavx6 |
|---|---|
| InChI | InChI=1S/C8H12O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3-4H,5-6H2,1-2H3/b4-3- |
| InChIKey | CPSQPCGPYWRIPB-ARJAWSKDSA-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 | FCzNDcviECP |
|---|---|
| Name | 3-HEXENEDIOIC ACID, DIMETHYL ESTER, (Z)- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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/b4-3- |
| InChIKey | CPSQPCGPYWRIPB-ARJAWSKDSA-N |
| Instrument Name | CH7 |
| Molecular Weight | 172.0732 |
| SMILES | COC(C\C=C/CC(OC)=O)=O |
| SPLASH | splash10-0abc-9400000000-132f1fa2e07163d58b48 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |