SpectraBase Compound ID | 6ciJq6wy61d |
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InChI | InChI=1S/C21H27BrN2O3S/c1-3-24(19-7-4-6-17(2)16-19)14-5-13-23-21(25)12-15-28(26,27)20-10-8-18(22)9-11-20/h4,6-11,16H,3,5,12-15H2,1-2H3,(H,23,25) |
InChIKey | MYECMMXDMLTACD-UHFFFAOYSA-N |
Mol Weight | 467.42 g/mol |
Molecular Formula | C21H27BrN2O3S |
Exact Mass | 466.092577 g/mol |
SpectraBase Spectrum ID | 5jhBpt7moVB |
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Name | 3-[(4-bromophenyl)sulfonyl]-N-[3-(ethyl-3-methylanilino)propyl]propanamide |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 466.092576908 u |
Formula | C21H27BrN2O3S |
InChI | InChI=1S/C21H27BrN2O3S/c1-3-24(19-7-4-6-17(2)16-19)14-5-13-23-21(25)12-15-28(26,27)20-10-8-18(22)9-11-20/h4,6-11,16H,3,5,12-15H2,1-2H3,(H,23,25) |
InChIKey | MYECMMXDMLTACD-UHFFFAOYSA-N |
Molecular Weight | 467.422 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_1208 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12269328 |