| SpectraBase Compound ID | GTTt7XhT2YE |
|---|---|
| InChI | InChI=1S/C9H20O2/c1-6(2)8(10)5-9(11)7(3)4/h6-11H,5H2,1-4H3/t8-,9-/m1/s1/i5D2 |
| InChIKey | CPHZAYIWNZNICS-BUCNIWEXSA-N |
| Mol Weight | 162.27 g/mol |
| Molecular Formula | C9H18D2O2 |
| Exact Mass | 162.158883 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AmAsFc22qZJ |
|---|---|
| Name | (3R*,5R*)-4,4-Dideuterio-2,6-Dimethyl-3,5-heptanediol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H18D2O2 |
| InChI | InChI=1S/C9H20O2/c1-6(2)8(10)5-9(11)7(3)4/h6-11H,5H2,1-4H3/t8-,9-/m1/s1/i5D2 |
| InChIKey | CPHZAYIWNZNICS-BUCNIWEXSA-N |
| Molecular Weight | 162.269 g/mol |
| SMILES | O[C@](C([C@](C(C)C)(O)[H])([D])[D])(C(C)C)[H] |
| SPLASH | splash10-006x-9000000000-94ee860e8cbae2eeec9a |
| Source of Spectrum | F-52-1803-3 |
| Wiley ID | 795211 |