| SpectraBase Compound ID | 7WMohWsVufO |
|---|---|
| InChI | InChI=1S/C16H18N2O3/c1-11-16(3,4)14(10-21-12(2)19)18(17-11)15(20)13-8-6-5-7-9-13/h5-10H,1-4H3/b14-10+ |
| InChIKey | BHUADQROLHTHMK-GXDHUFHOSA-N |
| Mol Weight | 286.33 g/mol |
| Molecular Formula | C16H18N2O3 |
| Exact Mass | 286.131742 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IlB39rTdJ8K |
|---|---|
| Name | 1-Benzoyl-4,5-dihydro-3,4,4-trimethyl-5-(acetoxymethylene)-1H-pyrazole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H18N2O3 |
| InChI | InChI=1S/C16H18N2O3/c1-11-16(3,4)14(10-21-12(2)19)18(17-11)15(20)13-8-6-5-7-9-13/h5-10H,1-4H3/b14-10+ |
| InChIKey | BHUADQROLHTHMK-GXDHUFHOSA-N |
| Molecular Weight | 286.331 g/mol |
| SMILES | C1(\C(N(N=C1C)C(=O)c1ccccc1)=C/OC(=O)C)(C)C |
| SPLASH | splash10-0a4i-0910000000-6f9c507613f0d13d0608 |
| Source of Spectrum | Y-28-51-7 |
| Synonyms | (E)-(2-benzoyl-4,4,5-trimethyl-2,4-dihydro-3H-pyrazol-3-ylidene)methyl acetate 4,5-Dihydro-3,4,4-trimethyl-5-(acetoxymethylene)-1-benzoyl-1H-pyrazole Acetic acid[(E)-(2-benzoyl-4,4,5-trimethyl-2-pyrazolin-3-ylidene)methyl]ester Acetic acid[(E)-(2-benzoyl-4,4,5-trimethyl-3-pyrazolylidene)methyl]ester [(E)-(2-benzoyl-4,4,5-trimethyl-pyrazol-3-ylidene)methyl]acetate [(E)-[4,4,5-trimethyl-2-(phenylcarbonyl)pyrazol-3-ylidene]methyl]ethanoate Acetic acid [(E)-(2-benzoyl-4,4,5-trimethyl-3-pyrazolylidene)methyl] ester [(E)-(2-benzoyl-4,4,5-trimethylpyrazol-3-ylidene)methyl] acetate [(E)-(2-benzoyl-4,4,5-trimethyl-pyrazol-3-ylidene)methyl] acetate [(E)-[4,4,5-trimethyl-2-(phenylcarbonyl)pyrazol-3-ylidene]methyl] ethanoate |
| Wiley ID | 1289856 |