| SpectraBase Compound ID | 2cNZw7wQrQu |
|---|---|
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h5-7H,2-4H2,1H3/b6-5+ |
| InChIKey | NDFKTBCGKNOHPJ-AATRIKPKSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2CwaXH9VYWh |
|---|---|
| Name | trans-2-Heptenal |
| CAS Registry Number | 18829-55-5 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h5-7H,2-4H2,1H3/b6-5+ |
| InChIKey | NDFKTBCGKNOHPJ-AATRIKPKSA-N |
| Instrument Name | Bruker WH-270 |
| Literature Reference | V.P. Baillargeon, J.K. Stille, J. Am. Chem. Soc. 108, 452 (1986). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |