| SpectraBase Compound ID | AydfxvY7Y5H |
|---|---|
| InChI | InChI=1S/C7H16O2/c1-3-7(9)5-4-6(2)8/h6-9H,3-5H2,1-2H3 |
| InChIKey | XTVHTJKQKUOEQA-UHFFFAOYSA-N |
| Mol Weight | 132.2 g/mol |
| Molecular Formula | C7H16O2 |
| Exact Mass | 132.11503 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 18TnpeAJbk |
|---|---|
| Name | 2,5-Heptanediol |
| Alternate Name(s) | 2,5-Dihydroxyheptane Heptane-2,5-diol |
| CAS Registry Number | 70444-25-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H16O2 |
| InChI | InChI=1S/C7H16O2/c1-3-7(9)5-4-6(2)8/h6-9H,3-5H2,1-2H3 |
| InChIKey | XTVHTJKQKUOEQA-UHFFFAOYSA-N |
| Molecular Weight | 132.203 g/mol |
| SMILES | OC(CCC(C)O)CC |
| SPLASH | splash10-0a4l-9000000000-f5433bcee03d7e1cb953 |
| Source of Spectrum | EK-1999-454-0 |
| Wiley ID | 1133907 |