DOKIJRPCPVSRQF-UHFFFAOYSA-N
Compound with spectra: 3 NMR, and 1 MS (GC)
| SpectraBase Compound ID | FA9deSfpC7T |
|---|---|
| InChI | InChI=1S/C7H10O/c1-5(8)7-2-6(3-7)4-7/h6H,2-4H2,1H3 |
| InChIKey | DOKIJRPCPVSRQF-UHFFFAOYSA-N |
| Mol Weight | 110.16 g/mol |
| Molecular Formula | C7H10O |
| Exact Mass | 110.073165 g/mol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | C-114-614-11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
- 1-ACETYL-BICYCLO-[1.1.1]-PENTANE
- 1-ACETOXY-BICYCLO-[1.1.1]-PENTANE
- 1-(3-bicyclo[1.1.1]pentanyl)ethanone
| Title | Journal or Book | Year |
|---|---|---|
| Influence ofσ-hyperconjugative interactions on13C substituent chemical shifts: experimental and theoretical study in 1-X,3-CH3-bicyclo[1.1.1]pentanes | Magnetic Resonance in Chemistry | 2004 |
| Transmission of polar substituent effects across the bicyclo[1.1.1]pentane ring system as monitored by19F NMR shifts | Magnetic Resonance in Chemistry | 2000 |
| A DFT/GIAO/NBO and experimental study of13C SCSs in 1-X-bicyclo[1.1.1]pentanes | Magnetic Resonance in Chemistry | 2000 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
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KnowItAll Mass Spectral Library
Author: Wiley
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