SpectraBase Compound ID | K6TqbAh8SO1 |
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InChI | InChI=1S/C16H23NO4S/c1-16(2,3)12-7-9-13(10-8-12)22(20,21)17-11-5-4-6-14(17)15(18)19/h7-10,14H,4-6,11H2,1-3H3,(H,18,19) |
InChIKey | RCDVRHPRTUWQJA-UHFFFAOYSA-N |
Mol Weight | 325.42 g/mol |
Molecular Formula | C16H23NO4S |
Exact Mass | 325.134779 g/mol |
SpectraBase Spectrum ID | GV0smEHZszH |
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Name | 1-[(4-tert-butylphenyl)sulfonyl]-2-piperidinecarboxylic acid |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 325.134779395 u |
Formula | C16H23NO4S |
InChI | InChI=1S/C16H23NO4S/c1-16(2,3)12-7-9-13(10-8-12)22(20,21)17-11-5-4-6-14(17)15(18)19/h7-10,14H,4-6,11H2,1-3H3,(H,18,19) |
InChIKey | RCDVRHPRTUWQJA-UHFFFAOYSA-N |
Molecular Weight | 325.423 g/mol |
NMR Offset | 18.4068 |
NMR Spectrometer Frequency | 500.137 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_9251 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13229092 |