| SpectraBase Compound ID | eNUFhxwbUu |
|---|---|
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h5-7H,2-4H2,1H3 |
| InChIKey | NDFKTBCGKNOHPJ-UHFFFAOYSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HEshagJpGD8 |
|---|---|
| Name | trans-2-heptenal |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h5-7H,2-4H2,1H3 |
| InChIKey | NDFKTBCGKNOHPJ-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 112.172 g/mol |
| SMILES | CCCCC=CC=O |
| SPLASH | splash10-0a6u-9000000000-c8770716a2072dd090ad |
| Source of Spectrum | SRH-2022-8678-0 |
| Wiley ID | 1830374 |