| SpectraBase Compound ID | L3uSm2uzXgR |
|---|---|
| InChI | InChI=1S/C6H14O2/c1-5(3-4-7)6(2)8/h5-8H,3-4H2,1-2H3/t5-,6+/m0/s1 |
| InChIKey | WOHXXIWTEHLCQK-NTSWFWBYSA-N |
| Mol Weight | 118.18 g/mol |
| Molecular Formula | C6H14O2 |
| Exact Mass | 118.09938 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9RWYceKErvE |
|---|---|
| Name | (3S,4R)-3-methylpentane-1,4-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H14O2 |
| InChI | InChI=1S/C6H14O2/c1-5(3-4-7)6(2)8/h5-8H,3-4H2,1-2H3/t5-,6+/m0/s1 |
| InChIKey | WOHXXIWTEHLCQK-NTSWFWBYSA-N |
| Molecular Weight | 118.176 g/mol |
| SMILES | OCC[C@@]([C@](O)(C)[H])(C)[H] |
| SPLASH | splash10-0a4u-9000000000-169e924ccea601801e4d |
| Source of Spectrum | KD-16-1359-4 |
| Wiley ID | 1637658 |