| SpectraBase Compound ID | 4DpgrwxF3qC |
|---|---|
| InChI | InChI=1S/C7H16O2/c1-2-3-4-5-7(9)6-8/h7-9H,2-6H2,1H3 |
| InChIKey | GCXZDAKFJKCPGK-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 | A7b8E5KvB7l |
|---|---|
| Name | 1,2-Heptanediol |
| CAS Registry Number | 3710-31-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H16O2 |
| InChI | InChI=1S/C7H16O2/c1-2-3-4-5-7(9)6-8/h7-9H,2-6H2,1H3 |
| InChIKey | GCXZDAKFJKCPGK-UHFFFAOYSA-N |
| Molecular Weight | 132.203 g/mol |
| SMILES | OCC(O)CCCCC |
| SPLASH | splash10-0a5c-9000000000-3fb343fb4bad407157e6 |
| Source of Spectrum | AA-0-645-3 |
| Synonyms | Heptane-1,2-diol AI3-13217 |
| Wiley ID | 6043 |