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(1R,2S,3R,5S)-2-(4-Bromo-phenyl)-3-nitro-bicyclo[3.2.1]octan-8-one
SpectraBase Compound ID FqG4jFfLn79
InChI InChI=1S/C14H14BrNO3/c15-10-4-1-8(2-5-10)13-11-6-3-9(14(11)17)7-12(13)16(18)19/h1-2,4-5,9,11-13H,3,6-7H2/t9-,11+,12-,13-/m1/s1
InChIKey SJOYSQBNAMKKJO-GWNIPJSYSA-N
Mol Weight 324.17 g/mol
Molecular Formula C14H14BrNO3
Exact Mass 323.015706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ELBQ0vtKYxD
Name (1R,2S,3R,5S)-2-(4-Bromo-phenyl)-3-nitro-bicyclo[3.2.1]octan-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14BrNO3
InChI InChI=1S/C14H14BrNO3/c15-10-4-1-8(2-5-10)13-11-6-3-9(14(11)17)7-12(13)16(18)19/h1-2,4-5,9,11-13H,3,6-7H2/t9-,11+,12-,13-/m1/s1
InChIKey SJOYSQBNAMKKJO-GWNIPJSYSA-N
Molecular Weight 324.174 g/mol
SMILES [C@@]1(N(=O)=O)([C@@]([C@@]2(CC[C@@](C2=O)(C1)[H])[H])(c1ccc(cc1)Br)[H])[H]
SPLASH splash10-014l-7900000000-710dfff9425f2bcb71a3
Source of Spectrum QE-15-11388-4j
Synonyms 1-(p-Bromophenyl)-2-nitro-8-oxobicyclo[3.2.1]octane
Wiley ID 1693050