| SpectraBase Compound ID | 1A9byxnjYA0 |
|---|---|
| InChI | InChI=1S/C10H21Cl/c1-4-9(2)6-5-7-10(3)8-11/h9-10H,4-8H2,1-3H3/t9-,10+/m1/s1 |
| InChIKey | PMSYBGHKGBBIIA-ZJUUUORDSA-N |
| Mol Weight | 176.73 g/mol |
| Molecular Formula | C10H21Cl |
| Exact Mass | 176.133178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LMy0ILiqHOp |
|---|---|
| Name | (2S,6R)-1-Chloranyl-2,6-dimethyl-octane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.133178376 u |
| Formula | C10H21Cl |
| InChI | InChI=1S/C10H21Cl/c1-4-9(2)6-5-7-10(3)8-11/h9-10H,4-8H2,1-3H3/t9-,10+/m1/s1 |
| InChIKey | PMSYBGHKGBBIIA-ZJUUUORDSA-N |
| Molecular Weight | 176.731 g/mol |
| SMILES | C(Cl)[C@](CCC[C@@](CC)(C)[H])(C)[H] |