| SpectraBase Compound ID | VDI8iN16ub |
|---|---|
| InChI | InChI=1S/C7H12O2/c1-4-6(2)5-7(8)9-3/h4H,5H2,1-3H3/b6-4+ |
| InChIKey | OUARJKDCCMXOEF-GQCTYLIASA-N |
| Mol Weight | 128.17 g/mol |
| Molecular Formula | C7H12O2 |
| Exact Mass | 128.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | K2KZ90xQv0O |
|---|---|
| Name | 3-PENTENOIC ACID, 3-METHYL-, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H12O2 |
| InChI | InChI=1S/C7H12O2/c1-4-6(2)5-7(8)9-3/h4H,5H2,1-3H3/b6-4+ |
| InChIKey | OUARJKDCCMXOEF-GQCTYLIASA-N |
| Instrument Name | CH7 |
| Molecular Weight | 128.0834 |
| SMILES | C\C=C\(CC(OC)=O)C |
| SPLASH | splash10-00kf-9000000000-611cff49377e4949cda1 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |