| SpectraBase Compound ID | J2J3Eq9uIOf |
|---|---|
| InChI | InChI=1S/C12H24/c1-4-6-8-11-10(3)12(11)9-7-5-2/h10-12H,4-9H2,1-3H3/t11-,12-/m1/s1 |
| InChIKey | GCORSVMWEXWDBK-VXGBXAGGSA-N |
| Mol Weight | 168.32 g/mol |
| Molecular Formula | C12H24 |
| Exact Mass | 168.187801 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I80TiaOLBtO |
|---|---|
| Name | (Trans)-1,2-dibutyl-3-methylcyclopropane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.187800773 u |
| Formula | C12H24 |
| InChI | InChI=1S/C12H24/c1-4-6-8-11-10(3)12(11)9-7-5-2/h10-12H,4-9H2,1-3H3/t11-,12-/m1/s1 |
| InChIKey | GCORSVMWEXWDBK-VXGBXAGGSA-N |
| Molecular Weight | 168.324 g/mol |
| SMILES | C1([C@@](CCCC)([C@@]1(CCCC)[H])[H])C |