| SpectraBase Compound ID | Bpm1u6BMCKt |
|---|---|
| InChI | InChI=1S/C9H12O3/c1-5-4-7(10)6-2-3-12-9(11)8(5)6/h6-7,10H,2-4H2,1H3 |
| InChIKey | SZDUUCCXZRJZRL-UHFFFAOYSA-N |
| Mol Weight | 168.19 g/mol |
| Molecular Formula | C9H12O3 |
| Exact Mass | 168.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BkHM9Ijupr0 |
|---|---|
| Name | SZDUUCCXZRJZRL-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C9H12O3 |
| InChI | InChI=1S/C9H12O3/c1-5-4-7(10)6-2-3-12-9(11)8(5)6/h6-7,10H,2-4H2,1H3 |
| InChIKey | SZDUUCCXZRJZRL-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2008) |
| Molecular Weight | 168.192 g/mol |
| Source File Reference | MHKO17736 |