![ethyl 3-({2-[(cyclohexylcarbonyl)amino]-3-phenylpropanoyl}amino)benzoate](/api/spectrum/3bjFKJ1pxW2/structure.png?h=300&w=458 "ethyl 3-({2-[(cyclohexylcarbonyl)amino]-3-phenylpropanoyl}amino)benzoate")
| SpectraBase Compound ID | H0NVgEjumDk |
|---|---|
| InChI | InChI=1S/C25H30N2O4/c1-2-31-25(30)20-14-9-15-21(17-20)26-24(29)22(16-18-10-5-3-6-11-18)27-23(28)19-12-7-4-8-13-19/h3,5-6,9-11,14-15,17,19,22H,2,4,7-8,12-13,16H2,1H3,(H,26,29)(H,27,28) |
| InChIKey | OJIZYVMHVCNYMX-UHFFFAOYSA-N |
| Mol Weight | 422.53 g/mol |
| Molecular Formula | C25H30N2O4 |
| Exact Mass | 422.220557 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 3bjFKJ1pxW2 |
|---|---|
| Name | ethyl 3-({2-[(cyclohexylcarbonyl)amino]-3-phenylpropanoyl}amino)benzoate |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 422.220557450 u |
| Formula | C25H30N2O4 |
| InChI | InChI=1S/C25H30N2O4/c1-2-31-25(30)20-14-9-15-21(17-20)26-24(29)22(16-18-10-5-3-6-11-18)27-23(28)19-12-7-4-8-13-19/h3,5-6,9-11,14-15,17,19,22H,2,4,7-8,12-13,16H2,1H3,(H,26,29)(H,27,28) |
| InChIKey | OJIZYVMHVCNYMX-UHFFFAOYSA-N |
| Molecular Weight | 422.525 g/mol |
| NMR Offset | 18.4067 |
| NMR Spectrometer Frequency | 500.137 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_9216 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/13229023 |