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2-[3-(4-fluorophenoxy)-5-nitro-anilino]tetrahydropyran-3,4,5-triol
SpectraBase Compound ID uLVxiT7WaF
InChI InChI=1S/C17H17FN2O7/c18-9-1-3-12(4-2-9)27-13-6-10(5-11(7-13)20(24)25)19-17-16(23)15(22)14(21)8-26-17/h1-7,14-17,19,21-23H,8H2/t14-,15+,16-,17?/m0/s1
InChIKey CFDQXCXHZXRQPY-TVXGVJEUSA-N
Mol Weight 380.33 g/mol
Molecular Formula C17H17FN2O7
Exact Mass 380.101979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1MKcA1BlbbN
Name 2-[3-(4-fluorophenoxy)-5-nitro-anilino]tetrahydropyran-3,4,5-triol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17FN2O7
InChI InChI=1S/C17H17FN2O7/c18-9-1-3-12(4-2-9)27-13-6-10(5-11(7-13)20(24)25)19-17-16(23)15(22)14(21)8-26-17/h1-7,14-17,19,21-23H,8H2/t14-,15+,16-,17?/m0/s1
InChIKey CFDQXCXHZXRQPY-TVXGVJEUSA-N
Molecular Weight 380.328 g/mol
SMILES N(C1[C@]([C@@]([C@](CO1)(O)[H])(O)[H])(O)[H])c1cc(N(=O)=O)cc(c1)Oc1ccc(cc1)F
SPLASH splash10-03di-9220000000-f179ec903295e743c3bb
Synonyms 2-[3-(4-fluorophenoxy)-5-nitroanilino]oxane-3,4,5-triol 2-[[3-(4-fluoranylphenoxy)-5-nitro-phenyl]amino]oxane-3,4,5-triol N-[3-(4-fluorophenoxy)-5-nitrophenyl]pentopyranosylamine
Wiley ID 1452026