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(2-Allyl-4-bromo-3-methoxy-6-nitrophenyl)acetonitrile
SpectraBase Compound ID FHOwiIirRC
InChI InChI=1S/C12H11BrN2O3/c1-3-4-9-8(5-6-14)11(15(16)17)7-10(13)12(9)18-2/h3,7H,1,4-5H2,2H3
InChIKey XXUMDRIIVUOCCE-UHFFFAOYSA-N
Mol Weight 311.14 g/mol
Molecular Formula C12H11BrN2O3
Exact Mass 309.995305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CxAGe9v6vnf
Name (2-Allyl-4-bromo-3-methoxy-6-nitrophenyl)acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11BrN2O3
InChI InChI=1S/C12H11BrN2O3/c1-3-4-9-8(5-6-14)11(15(16)17)7-10(13)12(9)18-2/h3,7H,1,4-5H2,2H3
InChIKey XXUMDRIIVUOCCE-UHFFFAOYSA-N
Molecular Weight 311.135 g/mol
SMILES c1(N(=O)=O)c(c(CC=C)c(c(c1)Br)OC)CC#N
SPLASH splash10-0o6v-0392000000-5bdab1d5d5e175135dc9
Source of Spectrum F-53-209-33
Synonyms 2-(4-bromo-3-methoxy-6-nitro-2-prop-2-enylphenyl)acetonitrile 2-(4-bromanyl-3-methoxy-6-nitro-2-prop-2-enyl-phenyl)ethanenitrile
Wiley ID 799860