SpectraBase Compound ID | 9wDS2IySodW |
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InChI | InChI=1S/C27H36N4O4S/c1-2-22-10-6-7-16-31(22)17-15-28-27(33)25(18-20-8-4-3-5-9-20)30-36(34,35)23-12-13-24-21(19-23)11-14-26(32)29-24/h3-5,8-9,12-13,19,22,25,30H,2,6-7,10-11,14-18H2,1H3,(H,28,33)(H,29,32) |
InChIKey | FWFGQWWTVQURBY-UHFFFAOYSA-N |
Mol Weight | 512.7 g/mol |
Molecular Formula | C27H36N4O4S |
Exact Mass | 512.245727 g/mol |
SpectraBase Spectrum ID | EqErEBxbaiy |
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Name | benzenepropanamide, N-[2-(2-ethyl-1-piperidinyl)ethyl]-alpha-[[(1,2,3,4-tetrahydro-2-oxo-6-quinolinyl)sulfonyl]amino]- |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 512.245726825 u |
Formula | C27H36N4O4S |
InChI | InChI=1S/C27H36N4O4S/c1-2-22-10-6-7-16-31(22)17-15-28-27(33)25(18-20-8-4-3-5-9-20)30-36(34,35)23-12-13-24-21(19-23)11-14-26(32)29-24/h3-5,8-9,12-13,19,22,25,30H,2,6-7,10-11,14-18H2,1H3,(H,28,33)(H,29,32) |
InChIKey | FWFGQWWTVQURBY-UHFFFAOYSA-N |
Molecular Weight | 512.669 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2021_1804 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13268275 |