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Benzenesulfonamide, N-[2-(adamantan-1-yloxy)ethyl]-2,5-dimethoxy-
SpectraBase Compound ID DDbEBu46bgk
InChI InChI=1S/C20H29NO5S/c1-24-17-3-4-18(25-2)19(10-17)27(22,23)21-5-6-26-20-11-14-7-15(12-20)9-16(8-14)13-20/h3-4,10,14-16,21H,5-9,11-13H2,1-2H3
InChIKey VQABICNVJDWDHU-UHFFFAOYSA-N
Mol Weight 395.51 g/mol
Molecular Formula C20H29NO5S
Exact Mass 395.176644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DxhuGQpUsYf
Name Benzenesulfonamide, N-[2-(adamantan-1-yloxy)ethyl]-2,5-dimethoxy-
Comments Computed using HOSE algorithm
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Exact Mass 395.176644207 u
Formula C20H29NO5S
InChI InChI=1S/C20H29NO5S/c1-24-17-3-4-18(25-2)19(10-17)27(22,23)21-5-6-26-20-11-14-7-15(12-20)9-16(8-14)13-20/h3-4,10,14-16,21H,5-9,11-13H2,1-2H3
InChIKey VQABICNVJDWDHU-UHFFFAOYSA-N
Molecular Weight 395.514 g/mol
SMILES COC1=CC=C(C(S(NCCOC23CC4CC(C3)CC(C2)C4)(=O)=O)=C1)OC