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Diethyl 6-bromo-4-(4-methylphenylsulfonamido)-4H-chromene-2,3-dicarboxylate
SpectraBase Compound ID D7SUOGcPEpJ
InChI InChI=1S/C22H22BrNO7S/c1-4-29-21(25)18-19(24-32(27,28)15-9-6-13(3)7-10-15)16-12-14(23)8-11-17(16)31-20(18)22(26)30-5-2/h6-12,19,24H,4-5H2,1-3H3
InChIKey ITPLAQIWFVGXHL-UHFFFAOYSA-N
Mol Weight 524.38 g/mol
Molecular Formula C22H22BrNO7S
Exact Mass 523.030036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 48PhoxhCDZg
Name Diethyl 6-bromo-4-(4-methylphenylsulfonamido)-4H-chromene-2,3-dicarboxylate
Alternate Name(s) Diethyl 6-bromo-4-{[(4-methylphenyl)sulfonyl]amino}-4H-chromene-2,3-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22BrNO7S
InChI InChI=1S/C22H22BrNO7S/c1-4-29-21(25)18-19(24-32(27,28)15-9-6-13(3)7-10-15)16-12-14(23)8-11-17(16)31-20(18)22(26)30-5-2/h6-12,19,24H,4-5H2,1-3H3
InChIKey ITPLAQIWFVGXHL-UHFFFAOYSA-N
Molecular Weight 524.382 g/mol
SMILES N(C1C(=C(Oc2c1cc(cc2)Br)C(=O)OCC)C(=O)OCC)S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-0gb9-0109000000-4b5feb6e80a56a6fd16e
Source of Spectrum F-62-5880-4
Wiley ID 1633612