SpectraBase Compound ID | KzrnKJwVFzJ |
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InChI | InChI=1S/C20H19BrN2O4/c21-16-10-8-15(9-11-16)19(26)23-17(13-14-5-2-1-3-6-14)20(27)22-12-4-7-18(24)25/h1-3,5-6,8-11,13H,4,7,12H2,(H,22,27)(H,23,26)(H,24,25)/b17-13- |
InChIKey | HVQKCIHMVXRGMZ-LGMDPLHJSA-N |
Mol Weight | 431.29 g/mol |
Molecular Formula | C20H19BrN2O4 |
Exact Mass | 430.05282 g/mol |
SpectraBase Spectrum ID | stFBS4Gh2 |
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Name | 4-({(2Z)-2-[(4-bromobenzoyl)amino]-3-phenyl-2-propenoyl}amino)butanoicacid |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 430.052820096 u |
Formula | C20H19BrN2O4 |
InChI | InChI=1S/C20H19BrN2O4/c21-16-10-8-15(9-11-16)19(26)23-17(13-14-5-2-1-3-6-14)20(27)22-12-4-7-18(24)25/h1-3,5-6,8-11,13H,4,7,12H2,(H,22,27)(H,23,26)(H,24,25)/b17-13- |
InChIKey | HVQKCIHMVXRGMZ-LGMDPLHJSA-N |
Molecular Weight | 431.286 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_1982 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12278737 |