| SpectraBase Compound ID | 5vDT3fC6dfa |
|---|---|
| InChI | InChI=1S/C8H16/c1-5-6-7-8(2,3)4/h5-6H,7H2,1-4H3/b6-5+ |
| InChIKey | NWZJLSKAFZXSQH-AATRIKPKSA-N |
| Mol Weight | 112.22 g/mol |
| Molecular Formula | C8H16 |
| Exact Mass | 112.125201 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | RQa5NC3Iz2 |
|---|---|
| Name | NWZJLSKAFZXSQH-AATRIKPKSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C8H16 |
| InChI | InChI=1S/C8H16/c1-5-6-7-8(2,3)4/h5-6H,7H2,1-4H3/b6-5+ |
| InChIKey | NWZJLSKAFZXSQH-AATRIKPKSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 112.215 g/mol |
| Source File Reference | MHKO9401 |