| SpectraBase Compound ID | 7KfbFeVtUpM |
|---|---|
| InChI | InChI=1S/C5H12O2/c1-5(7)3-2-4-6/h5-7H,2-4H2,1H3 |
| InChIKey | GLOBUAZSRIOKLN-UHFFFAOYSA-N |
| Mol Weight | 104.15 g/mol |
| Molecular Formula | C5H12O2 |
| Exact Mass | 104.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3LcYZ6dTFG |
|---|---|
| Name | 1,4-Pentanediol |
| CAS Registry Number | 626-95-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H12O2 |
| InChI | InChI=1S/C5H12O2/c1-5(7)3-2-4-6/h5-7H,2-4H2,1H3 |
| InChIKey | GLOBUAZSRIOKLN-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1039/c4gc00835a |
| Molecular Weight | 104.149 g/mol |
| SMILES | OC(CCCO)C |
| SPLASH | splash10-00dj-9000000000-521ca211d835dce43fb5 |
| Source of Spectrum | GCH-16-4081/SM17-arb1 |
| Synonyms | Pentane-1,4-diol |
| Wiley ID | 1755469 |