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(5S)-3,4-bis[(Isopropylidene)oxy])-1-[(3',5'-dinitrobenzoyl)oxy]-5-deoxy-5-fluoro-5-chloro-2-(formyloxy)-5-iodo-D-Arabinitol

View entire compound with spectra: 1 MS (GC)

(5S)-3,4-bis[(Isopropylidene)oxy])-1-[(3',5'-dinitrobenzoyl)oxy]-5-deoxy-5-fluoro-5-chloro-2-(formyloxy)-5-iodo-D-Arabinitol
SpectraBase Compound ID HVrQfbGS69V
InChI InChI=1S/C16H15ClFIN2O10/c1-15(2)30-12(13(31-15)16(17,18)19)11(29-7-22)6-28-14(23)8-3-9(20(24)25)5-10(4-8)21(26)27/h3-5,7,11-13H,6H2,1-2H3/t11-,12+,13+,16?/m1/s1
InChIKey CUURZMLOPXTRBA-FUZOXAPGSA-N
Mol Weight 576.66 g/mol
Molecular Formula C16H15ClFIN2O10
Exact Mass 575.944396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KiYkwXcygQn
Name (5S)-3,4-bis[(Isopropylidene)oxy])-1-[(3',5'-dinitrobenzoyl)oxy]-5-deoxy-5-fluoro-5-chloro-2-(formyloxy)-5-iodo-D-Arabinitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15ClFIN2O10
InChI InChI=1S/C16H15ClFIN2O10/c1-15(2)30-12(13(31-15)16(17,18)19)11(29-7-22)6-28-14(23)8-3-9(20(24)25)5-10(4-8)21(26)27/h3-5,7,11-13H,6H2,1-2H3/t11-,12+,13+,16?/m1/s1
InChIKey CUURZMLOPXTRBA-FUZOXAPGSA-N
Molecular Weight 576.656 g/mol
SMILES [C@@]1([C@@](OC(O1)(C)C)([C@@](COC(c1cc(N(=O)=O)cc(N(=O)=O)c1)=O)(OC=O)[H])[H])(C(F)(Cl)I)[H]
SPLASH splash10-0002-0900210000-4aeeab67904adfedf1bb
Source of Spectrum QE-14-6709-S-54
Wiley ID 1692228