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2,4,6-Triazatricyclo[5.2.1.0(2,6)]dec-8-en-3,5-dione, 10(E)-bromo-4-phenyl-
SpectraBase Compound ID 4b3gd9YOkyW
InChI InChI=1S/C13H10BrN3O2/c14-11-9-6-7-10(11)17-13(19)15(12(18)16(9)17)8-4-2-1-3-5-8/h1-7,9-11H/t9-,10+,11+
InChIKey VSEULQSYGUCBEL-UHFFFAOYSA-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 IK4zwDXjwqp
Name 2,4,6-Triazatricyclo[5.2.1.0(2,6)]dec-8-en-3,5-dione, 10(E)-bromo-4-phenyl-
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10BrN3O2
InChI InChI=1S/C13H10BrN3O2/c14-11-9-6-7-10(11)17-13(19)15(12(18)16(9)17)8-4-2-1-3-5-8/h1-7,9-11H/t9-,10+,11+
InChIKey VSEULQSYGUCBEL-UHFFFAOYSA-N
Molecular Weight 320.146 g/mol
SMILES C1(N2N(C(N1c1ccccc1)=O)[C@@]1([C@]([C@]2(C=C1)[H])(Br)[H])[H])=O
SPLASH splash10-014l-6911000000-158dfb53edbf5c14038a
Source of Spectrum J-62-945-42
Wiley ID 1319174