| SpectraBase Compound ID | HYKMXoNzXpB |
|---|---|
| InChI | InChI=1S/C7H14O/c1-2-4-6-8-7-5-3-1/h1-7H2 |
| InChIKey | HZIVRQOIUMAXID-UHFFFAOYSA-N |
| Mol Weight | 114.19 g/mol |
| Molecular Formula | C7H14O |
| Exact Mass | 114.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CpvI81AzJ0q |
|---|---|
| Name | OXOCANE,ISOMER-#1 |
| CAS Registry Number | 6572-98-1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C7H14O |
| InChI | InChI=1S/C7H14O/c1-2-4-6-8-7-5-3-1/h1-7H2 |
| InChIKey | HZIVRQOIUMAXID-UHFFFAOYSA-N |
| Literature Reference Author | W.L.MEYER,P.W.TAYLOR,S.A.REED,M.C.LEISTER,H.J.SCHNEIDER,G.SC HMIDT,F.E.EVANS,R.A. |
| Literature Reference Citation | J.ORG.CHEM.,57,291(1992) |
| Literature Reference DOI | 10.1021/jo00027a051 |
| Molecular Weight | 114.188 g/mol |
| Solvent | CBr2F2:CD2Cl2=3:1 |
| Source File Reference | UWCS1003 |