SpectraBase Compound ID | BmnGI8qlR1u |
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InChI | InChI=1S/C14H21N3O5S/c1-10-13(12(22-15-10)6-8-16(2)3)23(20,21)17-7-4-5-11(9-17)14(18)19/h6,8,11H,4-5,7,9H2,1-3H3,(H,18,19)/b8-6+ |
InChIKey | SFOOHJGNISSDHX-SOFGYWHQSA-N |
Mol Weight | 343.4 g/mol |
Molecular Formula | C14H21N3O5S |
Exact Mass | 343.120192 g/mol |
SpectraBase Spectrum ID | DrqnFwuiOsP |
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Name | 3-piperidinecarboxylic acid, 1-[[5-[(E)-2-(dimethylamino)ethenyl]-3-methyl-4-isoxazolyl]sulfonyl]- |
Copyright | Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 343.120191957 u |
Formula | C14H21N3O5S |
InChI | InChI=1S/C14H21N3O5S/c1-10-13(12(22-15-10)6-8-16(2)3)23(20,21)17-7-4-5-11(9-17)14(18)19/h6,8,11H,4-5,7,9H2,1-3H3,(H,18,19)/b8-6+ |
InChIKey | SFOOHJGNISSDHX-SOFGYWHQSA-N |
Molecular Weight | 343.398 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2021_2549 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13268946 |