| SpectraBase Compound ID | 3dt2XBnKX3K |
|---|---|
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h3-6,8H,2,7H2,1H3/b4-3+,6-5+ |
| InChIKey | MDRZSADXFOPYOC-VNKDHWASSA-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 | 1gfVqvxLuDn |
|---|---|
| Name | 2,4-Heptadien-1-ol |
| Alternate Name(s) | (2E,4E)-1-hepta-2,4-dienol (2E,4E)-2,4-Heptadien-1-ol (2E,4E)-hepta-2,4-dien-1-ol 2,4-Heptadien-1-ol, (E,E)- (E,E)-2,4-Heptadien-1-ol 2,4-Heptadien-1-ol, (2E,4E)- EINECS 251-535-3 |
| CAS Registry Number | 33467-79-7 |
| 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/h3-6,8H,2,7H2,1H3/b4-3+,6-5+ |
| InChIKey | MDRZSADXFOPYOC-VNKDHWASSA-N |
| Molecular Weight | 112.172 g/mol |
| SMILES | OC\C=C\C=C\CC |
| SPLASH | splash10-004l-9000000000-e7d25ac50bb0b1780009 |
| Source of Spectrum | A-1-45-1 |
| Wiley ID | 1123394 |