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Cyclohexanecarboxylic acid, 4-[[[(4-methoxyphenyl)sulfonyl]amino]methyl]-

View entire compound with spectra: 2 NMR

Cyclohexanecarboxylic acid, 4-[[[(4-methoxyphenyl)sulfonyl]amino]methyl]-
SpectraBase Compound ID 4E8UmGJdJwq
InChI InChI=1S/C15H21NO5S/c1-21-13-6-8-14(9-7-13)22(19,20)16-10-11-2-4-12(5-3-11)15(17)18/h6-9,11-12,16H,2-5,10H2,1H3,(H,17,18)
InChIKey YFLHPSZYOOQOHT-UHFFFAOYSA-N
Mol Weight 327.4 g/mol
Molecular Formula C15H21NO5S
Exact Mass 327.114044 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CiR1sreSje
Name Cyclohexanecarboxylic acid, 4-[[[(4-methoxyphenyl)sulfonyl]amino]methyl]-
Comments Computed using HOSE algorithm
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Exact Mass 327.114043949 u
Formula C15H21NO5S
InChI InChI=1S/C15H21NO5S/c1-21-13-6-8-14(9-7-13)22(19,20)16-10-11-2-4-12(5-3-11)15(17)18/h6-9,11-12,16H,2-5,10H2,1H3,(H,17,18)
InChIKey YFLHPSZYOOQOHT-UHFFFAOYSA-N
Molecular Weight 327.395 g/mol
SMILES N(S(C1=CC=C(C=C1)OC)(=O)=O)CC1CCC(C(=O)O)CC1