| SpectraBase Compound ID | 7LrKNUgyC0w |
|---|---|
| InChI | InChI=1S/C18H27O2P/c1-5-21(19,16-9-7-6-8-10-16)20-18-13-15(4)11-12-17(18)14(2)3/h5-10,14-15,17-18H,1,11-13H2,2-4H3/t15-,17+,18-,21?/m1/s1 |
| InChIKey | HTRQGORVSFJFHP-KQNNBSCQSA-N |
| Mol Weight | 306.39 g/mol |
| Molecular Formula | C18H27O2P |
| Exact Mass | 306.174867 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4q8zkWxZRrK |
|---|---|
| Name | no-Name |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.174867105 u |
| Formula | C18H27O2P |
| InChI | InChI=1S/C18H27O2P/c1-5-21(19,16-9-7-6-8-10-16)20-18-13-15(4)11-12-17(18)14(2)3/h5-10,14-15,17-18H,1,11-13H2,2-4H3/t15-,17+,18-,21?/m1/s1 |
| InChIKey | HTRQGORVSFJFHP-KQNNBSCQSA-N |
| Molecular Weight | 306.386 g/mol |
| SMILES | [C@@]1(OP(=O)(C2=CC=CC=C2)C=C)([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H] |