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2-(4-bromo-2-glycidyl-3-methoxy-6-nitro-phenyl)acetonitrile
SpectraBase Compound ID 2lJST4F9em6
InChI InChI=1S/C12H11BrN2O4/c1-18-12-9(4-7-6-19-7)8(2-3-14)11(15(16)17)5-10(12)13/h5,7H,2,4,6H2,1H3
InChIKey UPOXSLBNPOVUCG-UHFFFAOYSA-N
Mol Weight 327.13 g/mol
Molecular Formula C12H11BrN2O4
Exact Mass 325.99022 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4RVjN6Yvzc
Name 2-(4-bromo-2-glycidyl-3-methoxy-6-nitro-phenyl)acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11BrN2O4
InChI InChI=1S/C12H11BrN2O4/c1-18-12-9(4-7-6-19-7)8(2-3-14)11(15(16)17)5-10(12)13/h5,7H,2,4,6H2,1H3
InChIKey UPOXSLBNPOVUCG-UHFFFAOYSA-N
Molecular Weight 327.134 g/mol
SMILES c1(N(=O)=O)c(c(CC2OC2)c(c(c1)Br)OC)CC#N
SPLASH splash10-016r-0292000000-c9df4912de4407e41751
Source of Spectrum F-53-210-36
Synonyms 2-[4-bromanyl-3-methoxy-6-nitro-2-(oxiran-2-ylmethyl)phenyl]ethanenitrile 2-[4-bromo-3-methoxy-6-nitro-2-(2-oxiranylmethyl)phenyl]acetonitrile 2-[4-bromo-3-methoxy-6-nitro-2-(oxiran-2-ylmethyl)phenyl]acetonitrile
Wiley ID 799858