SpectraBase Compound ID | FU18KHaVQsG |
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InChI | InChI=1S/C21H21FN4O3S/c1-3-29-17-10-8-16(9-11-17)23-20(28)18-12-19(27)24-21(30-18)26-25-13(2)14-4-6-15(22)7-5-14/h4-11,18H,3,12H2,1-2H3,(H,23,28)(H,24,26,27)/b25-13+ |
InChIKey | ZMSXHUBTNVBIIN-DHRITJCHSA-N |
Mol Weight | 428.48 g/mol |
Molecular Formula | C21H21FN4O3S |
Exact Mass | 428.13184 g/mol |
SpectraBase Spectrum ID | DM0EbtP9he9 |
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Name | (2E)-N-(4-ethoxyphenyl)-2-{(2E)-2-[1-(4-fluorophenyl)ethylidene]hydrazono}-4-oxo-1,3-thiazinane-6-carboxamide |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 428.131839886 u |
Formula | C21H21FN4O3S |
InChI | InChI=1S/C21H21FN4O3S/c1-3-29-17-10-8-16(9-11-17)23-20(28)18-12-19(27)24-21(30-18)26-25-13(2)14-4-6-15(22)7-5-14/h4-11,18H,3,12H2,1-2H3,(H,23,28)(H,24,26,27)/b25-13+ |
InChIKey | ZMSXHUBTNVBIIN-DHRITJCHSA-N |
Molecular Weight | 428.482 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_1458 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12269817 |