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2-(2-Bromoethyl)benzo[de]isoquinoline-1,3-dione
SpectraBase Compound ID 6pcfazfH9Sw
InChI InChI=1S/C14H10BrNO2/c15-7-8-16-13(17)10-5-1-3-9-4-2-6-11(12(9)10)14(16)18/h1-6H,7-8H2
InChIKey FOIOCGDZONBYOA-UHFFFAOYSA-N
Mol Weight 304.14 g/mol
Molecular Formula C14H10BrNO2
Exact Mass 302.989492 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8wQ3vqEBtua
Name 2-(2-Bromoethyl)benzo[de]isoquinoline-1,3-dione
Comments Computed using HOSE algorithm
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Exact Mass 302.989491564 u
Formula C14H10BrNO2
InChI InChI=1S/C14H10BrNO2/c15-7-8-16-13(17)10-5-1-3-9-4-2-6-11(12(9)10)14(16)18/h1-6H,7-8H2
InChIKey FOIOCGDZONBYOA-UHFFFAOYSA-N
Molecular Weight 304.143 g/mol
SMILES C1(N(C(C=2C=3C(=CC=CC13)C=CC2)=O)CCBr)=O