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3-(4-Iodophenyl)-6-nitro-2H-chromen-2-one
SpectraBase Compound ID 1vkzDscjrvI
InChI InChI=1S/C15H8INO4/c16-11-3-1-9(2-4-11)13-8-10-7-12(17(19)20)5-6-14(10)21-15(13)18/h1-8H
InChIKey JXAMPXCVECISOL-UHFFFAOYSA-N
Mol Weight 393.14 g/mol
Molecular Formula C15H8INO4
Exact Mass 392.949803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1TJA4eQxCsa
Name 3-(4-Iodophenyl)-6-nitro-2H-chromen-2-one
Alternate Name(s) 3-(4-iodophenyl)-6-nitro-1-benzopyran-2-one 3-(4-iodophenyl)-6-nitro-chromen-2-one 3-(4-iodophenyl)-6-nitro-coumarin
CAS Registry Number 332030-56-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H8INO4
InChI InChI=1S/C15H8INO4/c16-11-3-1-9(2-4-11)13-8-10-7-12(17(19)20)5-6-14(10)21-15(13)18/h1-8H
InChIKey JXAMPXCVECISOL-UHFFFAOYSA-N
Molecular Weight 393.136 g/mol
SMILES c12c(OC(=O)C(=C2)c2ccc(I)cc2)ccc(c1)N(=O)=O
SPLASH splash10-0006-1319000000-26264092a5de47dd58ac
Wiley ID 1459302