| SpectraBase Compound ID | 9XPTRWiSxPD |
|---|---|
| InChI | InChI=1S/C13H16O2/c1-15-12-7-2-10(3-8-12)4-9-13(14)11-5-6-11/h2-3,7-8,11H,4-6,9H2,1H3 |
| InChIKey | VBGMKIIMHWHHBN-UHFFFAOYSA-N |
| Mol Weight | 204.27 g/mol |
| Molecular Formula | C13H16O2 |
| Exact Mass | 204.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IBSMvvh0Fn5 |
|---|---|
| Name | 1-Cyclopropyl-3-(4-methoxyphenyl)propan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.115029753 u |
| Formula | C13H16O2 |
| InChI | InChI=1S/C13H16O2/c1-15-12-7-2-10(3-8-12)4-9-13(14)11-5-6-11/h2-3,7-8,11H,4-6,9H2,1H3 |
| InChIKey | VBGMKIIMHWHHBN-UHFFFAOYSA-N |
| Molecular Weight | 204.269 g/mol |
| SMILES | C(C1CC1)(=O)CCC1=CC=C(C=C1)OC |