![(1S,10R)-7-OXATRICYCLO-[8.2.1.0-(1,6)]-TRIDECAN-8-ONE;DIASTEREOISOMERIC-MIXTURE](/api/spectrum/AVT7cGL1woT/structure.png?h=300&w=458 "(1S,10R)-7-OXATRICYCLO-[8.2.1.0-(1,6)]-TRIDECAN-8-ONE;DIASTEREOISOMERIC-MIXTURE")
| SpectraBase Compound ID | KI5BFVpicGW |
|---|---|
| InChI | InChI=1S/C12H18O2/c13-11-7-9-4-6-12(8-9)5-2-1-3-10(12)14-11/h9-10H,1-8H2/t9-,10?,12-/m0/s1 |
| InChIKey | USEOXYJVGMCRKT-VULFSTHESA-N |
| Mol Weight | 194.27 g/mol |
| Molecular Formula | C12H18O2 |
| Exact Mass | 194.13068 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AVT7cGL1woT |
|---|---|
| Name | (1S,10R)-7-Oxatricyclo[8.2.1.0(1,6)]tridecan-8-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H18O2 |
| InChI | InChI=1S/C12H18O2/c13-11-7-9-4-6-12(8-9)5-2-1-3-10(12)14-11/h9-10H,1-8H2/t9-,10?,12-/m0/s1 |
| InChIKey | USEOXYJVGMCRKT-VULFSTHESA-N |
| Molecular Weight | 194.274 g/mol |
| SMILES | C1(OC2[C@@]3(C[C@@](C1)([H])CC3)CCCC2)=O |
| SPLASH | splash10-0udi-0900000000-7b0095e4091fa6a6256a |
| Source of Spectrum | E1-45-462-13 |
| Wiley ID | 1553777 |