| SpectraBase Compound ID | 1fe9DD2eCVL |
|---|---|
| InChI | InChI=1S/C13H18O2/c1-5-6-11(15)12-9(2)10(14)7-8-13(12,3)4/h5-6H,7-8H2,1-4H3/b6-5+ |
| InChIKey | UQQQQVCDQHWDNJ-AATRIKPKSA-N |
| Mol Weight | 206.28 g/mol |
| Molecular Formula | C13H18O2 |
| Exact Mass | 206.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A1IctOn502z |
|---|---|
| Name | 3-(trans-1-Oxo-2-butenyl)-2,4,4-trimethyl-2-cyclohexen-1-one |
| CAS Registry Number | 53398-08-6 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C13H18O2 |
| InChI | InChI=1S/C13H18O2/c1-5-6-11(15)12-9(2)10(14)7-8-13(12,3)4/h5-6H,7-8H2,1-4H3/b6-5+ |
| InChIKey | UQQQQVCDQHWDNJ-AATRIKPKSA-N |
| Instrument Name | Bruker WH-270 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |