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(3R,4R)-3,4-Bis(methanesulfonyloxy)-1-(4-iodophenyl)pyrrolidine
SpectraBase Compound ID BwuvJhplTJv
InChI InChI=1S/C12H16INO6S2/c1-21(15,16)19-11-7-14(8-12(11)20-22(2,17)18)10-5-3-9(13)4-6-10/h3-6,11-12H,7-8H2,1-2H3/t11-,12-/m1/s1
InChIKey QUHLRBXHWPGONN-VXGBXAGGSA-N
Mol Weight 461.29 g/mol
Molecular Formula C12H16INO6S2
Exact Mass 460.946375 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11DElyGAU0j
Name (3R,4R)-3,4-Bis(methanesulfonyloxy)-1-(4-iodophenyl)pyrrolidine
Alternate Name(s) (3R,4R)-1-(4-iodophenyl)-4-[(methylsulfonyl)oxy]pyrrolidinyl methanesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16INO6S2
InChI InChI=1S/C12H16INO6S2/c1-21(15,16)19-11-7-14(8-12(11)20-22(2,17)18)10-5-3-9(13)4-6-10/h3-6,11-12H,7-8H2,1-2H3/t11-,12-/m1/s1
InChIKey QUHLRBXHWPGONN-VXGBXAGGSA-N
Molecular Weight 461.285 g/mol
SMILES [C@@]1(OS(=O)(=O)C)([C@](OS(=O)(=O)C)(CN(C1)c1ccc(cc1)I)[H])[H]
SPLASH splash10-0f6x-2963100000-b9bad99fb01ced7226f6
Source of Spectrum SO-0-250-4
Wiley ID 1611935