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2,4,6-Triazatricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-dione, 8-bromo-4-phenyl-
SpectraBase Compound ID H8qwyzFuGbA
InChI InChI=1S/C13H10BrN3O2/c14-10-6-9-7-11(10)17-13(19)15(12(18)16(9)17)8-4-2-1-3-5-8/h1-6,9,11H,7H2/t9-,11-/m1/s1
InChIKey YLIZZBNNHLIHQL-MWLCHTKSSA-N
Mol Weight 320.15 g/mol
Molecular Formula C13H10BrN3O2
Exact Mass 318.99564 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GaJGtkeeXRZ
Name 2,4,6-Triazatricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-dione, 8-bromo-4-phenyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10BrN3O2
InChI InChI=1S/C13H10BrN3O2/c14-10-6-9-7-11(10)17-13(19)15(12(18)16(9)17)8-4-2-1-3-5-8/h1-6,9,11H,7H2/t9-,11-/m1/s1
InChIKey YLIZZBNNHLIHQL-MWLCHTKSSA-N
Molecular Weight 320.146 g/mol
SMILES C=1[C@]2(N3N([C@@](C1Br)(C2)[H])C(N(C3=O)c1ccccc1)=O)[H]
SPLASH splash10-00kg-5911000000-773f82e277cc94c8c519
Wiley ID 1478795