| SpectraBase Compound ID | 2Tj3Uq9xnru |
|---|---|
| InChI | InChI=1S/C7H14O/c1-8-7-5-3-2-4-6-7/h7H,2-6H2,1H3/i2D2 |
| InChIKey | GHDIHPNJQVDFBL-CBTSVUPCSA-N |
| Mol Weight | 116.2 g/mol |
| Molecular Formula | C7H12D2O |
| Exact Mass | 116.117019 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3vOxHFq1V7T |
|---|---|
| Name | 4,4-Dideuteriomethoxycyclohexane |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12D2O |
| InChI | InChI=1S/C7H14O/c1-8-7-5-3-2-4-6-7/h7H,2-6H2,1H3/i2D2 |
| InChIKey | GHDIHPNJQVDFBL-CBTSVUPCSA-N |
| Molecular Weight | 116.200 g/mol |
| SMILES | C1(OC)CCC(CC1)([D])[D] |
| SPLASH | splash10-00di-9000000000-0b9b2b83850a2ec0abaa |
| Source of Spectrum | O-18-427-1 |
| Wiley ID | 1124897 |