![N-{(2Z)-3-(1,3-benzodioxol-5-yl)-2-[(4-methylbenzoyl)amino]-2-propenoyl}phenylalanine](/api/spectrum/KwXDnWttPks/structure.png?h=300&w=458 "N-{(2Z)-3-(1,3-benzodioxol-5-yl)-2-[(4-methylbenzoyl)amino]-2-propenoyl}phenylalanine")
| SpectraBase Compound ID | FZ8sNCiD7Q6 |
|---|---|
| InChI | InChI=1S/C27H24N2O6/c1-17-7-10-20(11-8-17)25(30)28-21(14-19-9-12-23-24(15-19)35-16-34-23)26(31)29-22(27(32)33)13-18-5-3-2-4-6-18/h2-12,14-15,22H,13,16H2,1H3,(H,28,30)(H,29,31)(H,32,33)/b21-14- |
| InChIKey | AMLNRKNOLQANQJ-STZFKDTASA-N |
| Mol Weight | 472.5 g/mol |
| Molecular Formula | C27H24N2O6 |
| Exact Mass | 472.163436 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | KwXDnWttPks |
|---|---|
| Name | N-{(2Z)-3-(1,3-benzodioxol-5-yl)-2-[(4-methylbenzoyl)amino]-2-propenoyl}phenylalanine |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 472.163436495 u |
| Formula | C27H24N2O6 |
| InChI | InChI=1S/C27H24N2O6/c1-17-7-10-20(11-8-17)25(30)28-21(14-19-9-12-23-24(15-19)35-16-34-23)26(31)29-22(27(32)33)13-18-5-3-2-4-6-18/h2-12,14-15,22H,13,16H2,1H3,(H,28,30)(H,29,31)(H,32,33)/b21-14- |
| InChIKey | AMLNRKNOLQANQJ-STZFKDTASA-N |
| Molecular Weight | 472.497 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_1939 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12278674 |