| SpectraBase Compound ID | Di9tKIgPY9J |
|---|---|
| InChI | InChI=1S/C9H16O3/c1-6-8(2,3)12-7(10)9(4,5)11-6/h6H,1-5H3 |
| InChIKey | JGHAEDLPQQYVGV-UHFFFAOYSA-N |
| Mol Weight | 172.22 g/mol |
| Molecular Formula | C9H16O3 |
| Exact Mass | 172.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2CZQKhQlH7M |
|---|---|
| Name | JGHAEDLPQQYVGV-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C9H16O3 |
| InChI | InChI=1S/C9H16O3/c1-6-8(2,3)12-7(10)9(4,5)11-6/h6H,1-5H3 |
| InChIKey | JGHAEDLPQQYVGV-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2008) |
| Molecular Weight | 172.224 g/mol |
| Source File Reference | MHKO18301 |