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Methyl (2-amino-6-bromo-3-cyano-4H-chromen-4-yl)cyanoacetate
SpectraBase Compound ID GzlZzciDelU
InChI InChI=1S/C14H10BrN3O3/c1-20-14(19)10(6-17)12-8-4-7(15)2-3-11(8)21-13(18)9(12)5-16/h2-4,10,12H,18H2,1H3
InChIKey QXQYOMGEWHEQJR-UHFFFAOYSA-N
Mol Weight 348.16 g/mol
Molecular Formula C14H10BrN3O3
Exact Mass 346.990554 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GkVANKEofAo
Name Methyl (2-amino-6-bromo-3-cyano-4H-chromen-4-yl)cyanoacetate
Alternate Name(s) Methyl 2-(2-amino-6-bromo-3-cyano-4H-chromen-4-yl)-2-cyanoacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10BrN3O3
InChI InChI=1S/C14H10BrN3O3/c1-20-14(19)10(6-17)12-8-4-7(15)2-3-11(8)21-13(18)9(12)5-16/h2-4,10,12H,18H2,1H3
InChIKey QXQYOMGEWHEQJR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200700493
Molecular Weight 348.156 g/mol
SMILES NC1=C(C(c2cc(ccc2O1)Br)C(C(=O)OC)C#N)C#N
SPLASH splash10-0zfs-6190000000-a454440ec6d16ffa3e1a
Source of Spectrum ASC-350-591/SM3-7b
Wiley ID 1766044