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N-(1-adamantylsulfinyl)-N-(2-phenoxyethyl)-1-adamantanesulfinamide
SpectraBase Compound ID 5hKLdoapV8z
InChI InChI=1S/C28H39NO3S2/c30-33(27-14-20-8-21(15-27)10-22(9-20)16-27)29(6-7-32-26-4-2-1-3-5-26)34(31)28-17-23-11-24(18-28)13-25(12-23)19-28/h1-5,20-25H,6-19H2/t20-,21+,22-,23?,24?,25?,27-,28?,33?,34?
InChIKey RCBFRPCKDOOZAA-ZKJFSHNVSA-N
Mol Weight 501.7 g/mol
Molecular Formula C28H39NO3S2
Exact Mass 501.237136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ARVtUZMOB0i
Name N-(1-adamantylsulfinyl)-N-(2-phenoxyethyl)-1-adamantanesulfinamide
Alternate Name(s) N-(1-adamantylsulfinyl)-N-(2-phenoxyethyl)adamantane-1-sulfinamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H39NO3S2
InChI InChI=1S/C28H39NO3S2/c30-33(27-14-20-8-21(15-27)10-22(9-20)16-27)29(6-7-32-26-4-2-1-3-5-26)34(31)28-17-23-11-24(18-28)13-25(12-23)19-28/h1-5,20-25H,6-19H2/t20-,21+,22-,23?,24?,25?,27-,28?,33?,34?
InChIKey RCBFRPCKDOOZAA-ZKJFSHNVSA-N
Molecular Weight 501.744 g/mol
SMILES c1cc(ccc1)OCCN(S(=O)C12CC3CC(C2)CC(C1)C3)S(C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])=O
SPLASH splash10-000i-7900000000-f1b193f4b1b709592de4
Wiley ID 1512150