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12,16-Dinydroxy-4,7,20-trioxa-14-thia-1,10-diazabicyclo[8.7.5]-docosane

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12,16-Dinydroxy-4,7,20-trioxa-14-thia-1,10-diazabicyclo[8.7.5]-docosane
SpectraBase Compound ID 9scqlTPL4Xz
InChI InChI=1S/C16H32N2O5S/c19-15-11-17-1-5-21-6-2-18(12-16(20)14-24-13-15)4-8-23-10-9-22-7-3-17/h15-16,19-20H,1-14H2
InChIKey XCTNLFLPSHDYQF-UHFFFAOYSA-N
Mol Weight 364.5 g/mol
Molecular Formula C16H32N2O5S
Exact Mass 364.203193 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID um98rRgYYK
Name 12,16-Dinydroxy-4,7,20-trioxa-14-thia-1,10-diazabicyclo[8.7.5]-docosane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 364.203193307 u
Formula C16H32N2O5S
InChI InChI=1S/C16H32N2O5S/c19-15-11-17-1-5-21-6-2-18(12-16(20)14-24-13-15)4-8-23-10-9-22-7-3-17/h15-16,19-20H,1-14H2
InChIKey XCTNLFLPSHDYQF-UHFFFAOYSA-N
Molecular Weight 364.501 g/mol
SMILES C1COCCN2CC(CSCC(CN(CCO1)CCOCC2)O)O