| SpectraBase Compound ID | 2CiR4SzONja |
|---|---|
| InChI | InChI=1S/C7H16O2/c1-5(2)7(9)6(3)4-8/h5-9H,4H2,1-3H3/t6-,7+/m0/s1 |
| InChIKey | KHVMKJQZHRKYEV-NKWVEPMBSA-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 | 4ytg6TKIxr3 |
|---|---|
| Name | (2S,3R)-2,4-dimethylpentane-1,3-diol |
| CAS Registry Number | 97906-32-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H16O2 |
| InChI | InChI=1S/C7H16O2/c1-5(2)7(9)6(3)4-8/h5-9H,4H2,1-3H3/t6-,7+/m0/s1 |
| InChIKey | KHVMKJQZHRKYEV-NKWVEPMBSA-N |
| Molecular Weight | 132.203 g/mol |
| SMILES | OC[C@@]([C@@](C(C)C)(O)[H])(C)[H] |
| SPLASH | splash10-0596-9000000000-c761999720a9a9e39046 |
| Source of Spectrum | KC-1988-90-14 |
| Wiley ID | 1133904 |