![(-)-(1R)-6,6-dimethyl-2-(3'-methoxypropyl)bicyclo[3.1.1]hept-2-ene](/api/spectrum/FAg2G0EWaor/structure.png?h=300&w=458 "(-)-(1R)-6,6-dimethyl-2-(3'-methoxypropyl)bicyclo[3.1.1]hept-2-ene")
| SpectraBase Compound ID | 4l83q2Q4CoY |
|---|---|
| InChI | InChI=1S/C13H22O/c1-13(2)11-7-6-10(12(13)9-11)5-4-8-14-3/h6,11-12H,4-5,7-9H2,1-3H3/t11?,12-/m0/s1 |
| InChIKey | SZOJNIHWCAMBRX-KIYNQFGBSA-N |
| Mol Weight | 194.32 g/mol |
| Molecular Formula | C13H22O |
| Exact Mass | 194.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FAg2G0EWaor |
|---|---|
| Name | (-)-(1R)-6,6-dimethyl-2-(3'-methoxypropyl)bicyclo[3.1.1]hept-2-ene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.167065327 u |
| Formula | C13H22O |
| InChI | InChI=1S/C13H22O/c1-13(2)11-7-6-10(12(13)9-11)5-4-8-14-3/h6,11-12H,4-5,7-9H2,1-3H3/t11?,12-/m0/s1 |
| InChIKey | SZOJNIHWCAMBRX-KIYNQFGBSA-N |
| Molecular Weight | 194.318 g/mol |
| SMILES | [C@]12(C(C)(C)C(C2)CC=C1CCCOC)[H] |