SpectraBase Compound ID | JQRSGojMefl |
---|---|
InChI | InChI=1S/C15H14N2O6/c18-13(19)5-6-16-14(20)11(9-10-3-1-7-22-10)17-15(21)12-4-2-8-23-12/h1-4,7-9H,5-6H2,(H,16,20)(H,17,21)(H,18,19)/b11-9- |
InChIKey | LQYBBCQUTUGQDR-LUAWRHEFSA-N |
Mol Weight | 318.29 g/mol |
Molecular Formula | C15H14N2O6 |
Exact Mass | 318.085186 g/mol |
SpectraBase Spectrum ID | BriJWesJHSW |
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Name | N-[(2Z)-2-(2-furoylamino)-3-(2-furyl)-2-propenoyl]-beta-alanine |
Copyright | Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 318.085186173 u |
Formula | C15H14N2O6 |
InChI | InChI=1S/C15H14N2O6/c18-13(19)5-6-16-14(20)11(9-10-3-1-7-22-10)17-15(21)12-4-2-8-23-12/h1-4,7-9H,5-6H2,(H,16,20)(H,17,21)(H,18,19)/b11-9- |
InChIKey | LQYBBCQUTUGQDR-LUAWRHEFSA-N |
Molecular Weight | 318.285 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_1969 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12278724 |