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4,7-Di(bromomethyl)-1,3-dihydro-2H-isoindole-1,3-dione-2-acetic acid
SpectraBase Compound ID Gabu0m4Y8zM
InChI InChI=1S/C12H9Br2NO4/c13-3-6-1-2-7(4-14)10-9(6)11(18)15(12(10)19)5-8(16)17/h1-2H,3-5H2,(H,16,17)
InChIKey YSZQPRPWWWGARD-UHFFFAOYSA-N
Mol Weight 391.02 g/mol
Molecular Formula C12H9Br2NO4
Exact Mass 388.889834 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G3fBbb4SHyp
Name 4,7-Di(bromomethyl)-1,3-dihydro-2H-isoindole-1,3-dione-2-acetic acid
Comments Less than 3 mono-isotopic peaks
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Formula C12H9Br2NO4
InChI InChI=1S/C12H9Br2NO4/c13-3-6-1-2-7(4-14)10-9(6)11(18)15(12(10)19)5-8(16)17/h1-2H,3-5H2,(H,16,17)
InChIKey YSZQPRPWWWGARD-UHFFFAOYSA-N
Molecular Weight 391.015 g/mol
SMILES OC(CN1C(c2c(ccc(c2C1=O)CBr)CBr)=O)=O
SPLASH splash10-0a4i-0009000000-ff2fc7d11c31e3388cc0
Source of Spectrum QE-11-382-11
Synonyms [4,7-bis(bromomethyl)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]acetic acid
Wiley ID 1586498