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2-Oxa-6-azatricyclo[3.3.1.1(3,7)]decan-4-ol, 8-iodo-6-(phenylsulfonyl)-,acetate (ester), (1.alpha.,3.beta.,4.beta.,5.alpha.,7.beta.,8.alpha.)-
SpectraBase Compound ID EHI2poMWpTb
InChI InChI=1S/C16H18INO5S/c1-9(19)22-16-12-8-13-15(17)11(7-14(16)23-13)18(12)24(20,21)10-5-3-2-4-6-10/h2-6,11-16H,7-8H2,1H3
InChIKey SCYUXTYXVQKTNE-UHFFFAOYSA-N
Mol Weight 463.29 g/mol
Molecular Formula C16H18INO5S
Exact Mass 462.995039 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C2R62EU5GRW
Name 2-Oxa-6-azatricyclo[3.3.1.1(3,7)]decan-4-ol, 8-iodo-6-(phenylsulfonyl)-,acetate (ester), (1.alpha.,3.beta.,4.beta.,5.alpha.,7.beta.,8.alpha.)-
Alternate Name(s) 2-Oxa-6-azatricyclo[3.3.1.1(3,7)]decan-4-ol, 8-iodo-6-(phenylsulfonyl)-, acetate (ester), (1alpha,3beta,4beta,5alpha,7beta,8alpha)- 8-iodo-6-(phenylsulfonyl)-2-oxa-6-azatricyclo[3.3.1.1(3,7)]dec-4-yl acetate N-Benzolsulfonyl-4N-acetoxy-8n-iodo-2-oxa-6-aza-adamantane
CAS Registry Number 50267-29-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18INO5S
InChI InChI=1S/C16H18INO5S/c1-9(19)22-16-12-8-13-15(17)11(7-14(16)23-13)18(12)24(20,21)10-5-3-2-4-6-10/h2-6,11-16H,7-8H2,1H3
InChIKey SCYUXTYXVQKTNE-UHFFFAOYSA-N
Molecular Weight 463.286 g/mol
SMILES CC(=O)OC1C2CC3C(C(CC1O3)N2S(c1ccccc1)(=O)=O)I
SPLASH splash10-0006-9121000000-be11a168a89d96048479
Source of Spectrum H-56-1982-28
Wiley ID 1391259