| SpectraBase Compound ID | BqRKNd2K2Br |
|---|---|
| InChI | InChI=1S/C10H22/c1-8(2)6-10(5)7-9(3)4/h8-10H,6-7H2,1-5H3 |
| InChIKey | YNLBBDHDNIXQNL-UHFFFAOYSA-N |
| Mol Weight | 142.29 g/mol |
| Molecular Formula | C10H22 |
| Exact Mass | 142.172151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 56g6qNe2G0T |
|---|---|
| Name | Heptane, 2,4,6-trimethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.172150708 u |
| Formula | C10H22 |
| InChI | InChI=1S/C10H22/c1-8(2)6-10(5)7-9(3)4/h8-10H,6-7H2,1-5H3 |
| InChIKey | YNLBBDHDNIXQNL-UHFFFAOYSA-N |
| Molecular Weight | 142.286 g/mol |
| SMILES | CC(CC(CC(C)C)C)C |