| SpectraBase Compound ID | 39rBH4wEV0o |
|---|---|
| InChI | InChI=1S/C7H12O/c1-5-3-4-7(8)6(5)2/h5-6H,3-4H2,1-2H3/t5-,6+/m1/s1 |
| InChIKey | NHHSVMBOTBXSFH-RITPCOANSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FvBZwQ9f7YX |
|---|---|
| Name | NHHSVMBOTBXSFH-RITPCOANSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-5-3-4-7(8)6(5)2/h5-6H,3-4H2,1-2H3/t5-,6+/m1/s1 |
| InChIKey | NHHSVMBOTBXSFH-RITPCOANSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 112.172 g/mol |
| Source File Reference | MHKO2907 |