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N-[1-(1-adamantyl)propyl]-3,4-bis(chloranyl)-2-methoxy-benzenesulfonamide
SpectraBase Compound ID NDgPbrw47C
InChI InChI=1S/C20H27Cl2NO3S/c1-3-17(20-9-12-6-13(10-20)8-14(7-12)11-20)23-27(24,25)16-5-4-15(21)18(22)19(16)26-2/h4-5,12-14,17,23H,3,6-11H2,1-2H3
InChIKey RYMXZBIYXVRKNB-UHFFFAOYSA-N
Mol Weight 432.41 g/mol
Molecular Formula C20H27Cl2NO3S
Exact Mass 431.10887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AgfgP0uviiU
Name N-[1-(1-adamantyl)propyl]-3,4-bis(chloranyl)-2-methoxy-benzenesulfonamide
Alternate Name(s) N-[1-(1-adamantyl)propyl]-3,4-dichloro-2-methoxy-benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27Cl2NO3S
InChI InChI=1S/C20H27Cl2NO3S/c1-3-17(20-9-12-6-13(10-20)8-14(7-12)11-20)23-27(24,25)16-5-4-15(21)18(22)19(16)26-2/h4-5,12-14,17,23H,3,6-11H2,1-2H3
InChIKey RYMXZBIYXVRKNB-UHFFFAOYSA-N
Molecular Weight 432.406 g/mol
SMILES N(S(c1c(c(Cl)c(cc1)Cl)OC)(=O)=O)C(C12CC3CC(C2)CC(C1)C3)CC
SPLASH splash10-000m-7920100000-b1e6c71ce06553f2412b
Wiley ID 1465101