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N-[(4S,5S)-4-([1,1'-Biphenyl]-4-yl)-2,2-dimethyl-1,3-dioxan-5-yl]propane-1-sulfonamide

View entire compound with spectra: 1 MS (GC)

N-[(4S,5S)-4-([1,1'-Biphenyl]-4-yl)-2,2-dimethyl-1,3-dioxan-5-yl]propane-1-sulfonamide
SpectraBase Compound ID LSXkX8yZd7i
InChI InChI=1S/C21H27NO4S/c1-4-14-27(23,24)22-19-15-25-21(2,3)26-20(19)18-12-10-17(11-13-18)16-8-6-5-7-9-16/h5-13,19-20,22H,4,14-15H2,1-3H3/t19-,20-/m0/s1
InChIKey RDBNLDFXRHSJLQ-PMACEKPBSA-N
Mol Weight 389.51 g/mol
Molecular Formula C21H27NO4S
Exact Mass 389.16608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6FkM2l7f2hb
Name N-[(4S,5S)-4-([1,1'-Biphenyl]-4-yl)-2,2-dimethyl-1,3-dioxan-5-yl]propane-1-sulfonamide
Alternate Name(s) N-((4S,5S)-4-([1,1'-biphenyl]-4-yl)-2,2-dimethyl-1,3-dioxan-5-yl)propane-1-sulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27NO4S
InChI InChI=1S/C21H27NO4S/c1-4-14-27(23,24)22-19-15-25-21(2,3)26-20(19)18-12-10-17(11-13-18)16-8-6-5-7-9-16/h5-13,19-20,22H,4,14-15H2,1-3H3/t19-,20-/m0/s1
InChIKey RDBNLDFXRHSJLQ-PMACEKPBSA-N
Literature Reference DOI 10.1002_1522-2675(200211)85_11_3657
Molecular Weight 389.510 g/mol
SMILES N(S(=O)(=O)CCC)[C@@]1([C@@](OC(OC1)(C)C)(c1ccc(cc1)-c1ccccc1)[H])[H]
SPLASH splash10-001i-0902000000-40ade51f42eecd520cfb
Source of Spectrum H-85-3671-(S,S)_17b
Wiley ID 1787566