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(+)-(S)-2-(2-Bromo-1-methylethyl)-4-nitro-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID BJ1fLzA1I05
InChI InChI=1S/C11H9BrN2O4/c1-6(5-12)13-10(15)7-3-2-4-8(14(17)18)9(7)11(13)16/h2-4,6H,5H2,1H3/t6-/m0/s1
InChIKey PVFABGSEYXJQBS-LURJTMIESA-N
Mol Weight 313.11 g/mol
Molecular Formula C11H9BrN2O4
Exact Mass 311.97457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HL13hA23Mek
Name (+)-(S)-2-(2-Bromo-1-methylethyl)-4-nitro-1H-isoindole-1,3(2H)-dione
Alternate Name(s) 2-[(1S)-2-bromo-1-methylethyl]-4-nitro-1H-isoindole-1,3(2H)-dione
Comments Less than 3 mono-isotopic peaks
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Formula C11H9BrN2O4
InChI InChI=1S/C11H9BrN2O4/c1-6(5-12)13-10(15)7-3-2-4-8(14(17)18)9(7)11(13)16/h2-4,6H,5H2,1H3/t6-/m0/s1
InChIKey PVFABGSEYXJQBS-LURJTMIESA-N
Molecular Weight 313.107 g/mol
SMILES C1(N(C(c2cccc(c12)N(=O)=O)=O)[C@](CBr)(C)[H])=O
SPLASH splash10-014i-0090000000-3fb6d8236bd258ed0e26
Source of Spectrum QC-11-3629-6
Wiley ID 860092