| SpectraBase Compound ID | ERqcfZkpUlN |
|---|---|
| InChI | InChI=1S/C15H22/c1-4-5-6-7-8-12-15-13(2)10-9-11-14(15)3/h8-12H,4-7H2,1-3H3/b12-8+ |
| InChIKey | JDUDPZXEQQHXHS-XYOKQWHBSA-N |
| Mol Weight | 202.34 g/mol |
| Molecular Formula | C15H22 |
| Exact Mass | 202.172151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AxSyuPEkYcP |
|---|---|
| Name | (E)-2,6-Dimethyl-1-hepten-2-ylbenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.172150708 u |
| Formula | C15H22 |
| InChI | InChI=1S/C15H22/c1-4-5-6-7-8-12-15-13(2)10-9-11-14(15)3/h8-12H,4-7H2,1-3H3/b12-8+ |
| InChIKey | JDUDPZXEQQHXHS-XYOKQWHBSA-N |
| Molecular Weight | 202.341 g/mol |
| SMILES | C=1C(=C(\C=C\CCCCC)C(=CC1)C)C |