| SpectraBase Compound ID | Apu2Dqsfy3O |
|---|---|
| InChI | InChI=1S/C8H12O2/c9-8(10)7-5-3-1-2-4-6-7/h1-2,7H,3-6H2,(H,9,10) |
| InChIKey | MVALBWJIVQGSGK-UHFFFAOYSA-N |
| Mol Weight | 140.18 g/mol |
| Molecular Formula | C8H12O2 |
| Exact Mass | 140.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DVGoWUDN2FS |
|---|---|
| Name | CYCLOHEPT-4-ENECARBOXYLIC ACID |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H12O2 |
| InChI | InChI=1S/C8H12O2/c9-8(10)7-5-3-1-2-4-6-7/h1-2,7H,3-6H2,(H,9,10) |
| InChIKey | MVALBWJIVQGSGK-UHFFFAOYSA-N |
| Molecular Weight | 140.0834 |
| SMILES | OC(=O)C1CCC=CCC1 |
| SPLASH | splash10-01bc-9000000000-336f7e46e1978ca00d34 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |