| SpectraBase Compound ID | 6CEs65TkD2b |
|---|---|
| InChI | InChI=1S/C8H14O/c1-3-8(2)6-4-5-7-9/h4-5,7-8H,3,6H2,1-2H3/b5-4+ |
| InChIKey | KXROKJLIUFHIKQ-SNAWJCMRSA-N |
| Mol Weight | 126.2 g/mol |
| Molecular Formula | C8H14O |
| Exact Mass | 126.104465 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IgZaOD4YTGP |
|---|---|
| Name | 5-Methyl-2-heptenal |
| CAS Registry Number | 94705-03-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H14O |
| InChI | InChI=1S/C8H14O/c1-3-8(2)6-4-5-7-9/h4-5,7-8H,3,6H2,1-2H3/b5-4+ |
| InChIKey | KXROKJLIUFHIKQ-SNAWJCMRSA-N |
| Molecular Weight | 126.199 g/mol |
| SMILES | C(\C=C\C=O)C(CC)C |
| SPLASH | splash10-00di-9000000000-c3d1e85d49d7a84eb615 |
| Source of Spectrum | H-67-1474-0 |
| Synonyms | (E)-5-methyl-2-heptenal |
| Wiley ID | 1130062 |