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(2S,3S,4E)-2-AMINO-2,3-N,O-CARBONYL-1-O-(METHYLSULFONYL)-OCTADEC-4-ENE-1,3-DIOL
SpectraBase Compound ID GU0ObCE6LRW
InChI InChI=1S/C20H37NO5S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-18(21-20(22)26-19)17-25-27(2,23)24/h15-16,18-19H,3-14,17H2,1-2H3,(H,21,22)/b16-15+/t18-,19-/m0/s1
InChIKey DWQOMOOAVBQLPS-FLFATNBMSA-N
Mol Weight 403.6 g/mol
Molecular Formula C20H37NO5S
Exact Mass 403.239244 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JfcOclkiANc
Name (2S,3S,4E)-2-AMINO-2,3-N,O-CARBONYL-1-O-(METHYLSULFONYL)-OCTADEC-4-ENE-1,3-DIOL
Compound Number 40
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H37NO5S
InChI InChI=1S/C20H37NO5S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-18(21-20(22)26-19)17-25-27(2,23)24/h15-16,18-19H,3-14,17H2,1-2H3,(H,21,22)/b16-15+/t18-,19-/m0/s1
InChIKey DWQOMOOAVBQLPS-FLFATNBMSA-N
Literature Reference Author A.TARNOWSKI,O.RETZ,T.BAER,R.R.SCHMIDT
Literature Reference Citation EUR.J.ORG.CHEM.,1129(2005)
Molecular Weight 403.577 g/mol
Sample ID 30852
Solvent CDCl3