| SpectraBase Compound ID | E5TYrDKG1hW |
|---|---|
| InChI | InChI=1S/C29H29ClN2O4/c1-36-29(35)23-17-9-8-16-22(23)26(27(33)31-21-14-6-3-7-15-21)32(25-19-11-10-18-24(25)30)28(34)20-12-4-2-5-13-20/h2,4-5,8-13,16-19,21,26H,3,6-7,14-15H2,1H3,(H,31,33) |
| InChIKey | DLKXMRDLFAVBIW-UHFFFAOYSA-N |
| Mol Weight | 505.01 g/mol |
| Molecular Formula | C29H29ClN2O4 |
| Exact Mass | 504.181585 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 87dGuVsQLCg |
|---|---|
| Name | Methyl 2-(1-(N-(2-chlorophenyl)benzamido)-2-(cyclohexylamino)-2-oxoethyl)benzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H29ClN2O4 |
| InChI | InChI=1S/C29H29ClN2O4/c1-36-29(35)23-17-9-8-16-22(23)26(27(33)31-21-14-6-3-7-15-21)32(25-19-11-10-18-24(25)30)28(34)20-12-4-2-5-13-20/h2,4-5,8-13,16-19,21,26H,3,6-7,14-15H2,1H3,(H,31,33) |
| InChIKey | DLKXMRDLFAVBIW-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1016/j.tet.2015.11.051 |
| Molecular Weight | 505.014 g/mol |
| SMILES | N(C(C(N(c1ccccc1Cl)C(=O)c1ccccc1)c1ccccc1C(OC)=O)=O)C1CCCCC1 |
| SPLASH | splash10-0adi-3891000000-2c9e13b02d01bc2ea3a2 |
| Source of Spectrum | F-72-340-5b |
| Wiley ID | 1805922 |