![tert-butyl 2-{[1-{[(2-hydrazino-2-oxoethyl)amino]carbonyl}-3-(methylsulfanyl)propyl]amino}-1-(4-hydroxybenzyl)-2-oxoethylcarbamate](/api/spectrum/G7yw7szZ0D1/structure.png?h=300&w=458 "tert-butyl 2-{[1-{[(2-hydrazino-2-oxoethyl)amino]carbonyl}-3-(methylsulfanyl)propyl]amino}-1-(4-hydroxybenzyl)-2-oxoethylcarbamate")
| SpectraBase Compound ID | CQp8WGSyu6s |
|---|---|
| InChI | InChI=1S/C21H33N5O6S/c1-21(2,3)32-20(31)25-16(11-13-5-7-14(27)8-6-13)19(30)24-15(9-10-33-4)18(29)23-12-17(28)26-22/h5-8,15-16,27H,9-12,22H2,1-4H3,(H,23,29)(H,24,30)(H,25,31)(H,26,28) |
| InChIKey | YOPNHDBLHYEXAD-UHFFFAOYSA-N |
| Mol Weight | 483.6 g/mol |
| Molecular Formula | C21H33N5O6S |
| Exact Mass | 483.215155 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | G7yw7szZ0D1 |
|---|---|
| Name | tert-butyl 2-{[1-{[(2-hydrazino-2-oxoethyl)amino]carbonyl}-3-(methylsulfanyl)propyl]amino}-1-(4-hydroxybenzyl)-2-oxoethylcarbamate |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 483.215154971 u |
| Formula | C21H33N5O6S |
| InChI | InChI=1S/C21H33N5O6S/c1-21(2,3)32-20(31)25-16(11-13-5-7-14(27)8-6-13)19(30)24-15(9-10-33-4)18(29)23-12-17(28)26-22/h5-8,15-16,27H,9-12,22H2,1-4H3,(H,23,29)(H,24,30)(H,25,31)(H,26,28) |
| InChIKey | YOPNHDBLHYEXAD-UHFFFAOYSA-N |
| Molecular Weight | 483.584 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_1451 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12269802 |