SpectraBase Compound ID | 63SBMTLS3nC |
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InChI | InChI=1S/C21H21ClN2O5/c1-13-11-15(7-8-16(13)22)28-9-4-10-29-19-14(5-3-6-18(19)27-2)12-17-20(25)24-21(26)23-17/h3,5-8,11-12H,4,9-10H2,1-2H3,(H2,23,24,25,26)/b17-12- |
InChIKey | KWNVOOHIUYRLNO-ATVHPVEESA-N |
Mol Weight | 416.86 g/mol |
Molecular Formula | C21H21ClN2O5 |
Exact Mass | 416.113899 g/mol |
SpectraBase Spectrum ID | 9XqxnDIYJw3 |
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Name | (5Z)-5-{2-[3-(4-chloro-3-methylphenoxy)propoxy]-3-methoxybenzylidene}-2,4-imidazolidinedione |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 416.113899479 u |
Formula | C21H21ClN2O5 |
InChI | InChI=1S/C21H21ClN2O5/c1-13-11-15(7-8-16(13)22)28-9-4-10-29-19-14(5-3-6-18(19)27-2)12-17-20(25)24-21(26)23-17/h3,5-8,11-12H,4,9-10H2,1-2H3,(H2,23,24,25,26)/b17-12- |
InChIKey | KWNVOOHIUYRLNO-ATVHPVEESA-N |
Molecular Weight | 416.861 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_32 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12259682 |