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N-(p-tolylsulfonyl)valine

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N-(p-tolylsulfonyl)valine
SpectraBase Compound ID KtgrumJe4oq
InChI InChI=1S/C12H17NO4S/c1-8(2)11(12(14)15)13-18(16,17)10-6-4-9(3)5-7-10/h4-8,11,13H,1-3H3,(H,14,15)
InChIKey ZYFUNXTYNIYYJI-UHFFFAOYSA-N
Mol Weight 271.33 g/mol
Molecular Formula C12H17NO4S
Exact Mass 271.087829 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J53jsa68b7o
Name N-[(4-methylphenyl)sulfonyl]valine
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 271.087829201 u
Formula C12H17NO4S
InChI InChI=1S/C12H17NO4S/c1-8(2)11(12(14)15)13-18(16,17)10-6-4-9(3)5-7-10/h4-8,11,13H,1-3H3,(H,14,15)
InChIKey ZYFUNXTYNIYYJI-UHFFFAOYSA-N
Molecular Weight 271.331 g/mol
NMR Offset 18.4068
NMR Spectrometer Frequency 500.137
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9244
Solvent DMSO-d6
Source Vendor ID: NMR/13229084