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3,3'-(p-Nitrobenzylidene)-4,5'-epoxy-dicoumarin
SpectraBase Compound ID 6lN69NgjhSQ
InChI InChI=1S/C25H13NO7/c27-24-20-19(13-9-11-14(12-10-13)26(29)30)21-23(16-6-2-4-8-18(16)32-25(21)28)33-22(20)15-5-1-3-7-17(15)31-24/h1-12,19H
InChIKey DQLZBTZWNOPDIW-UHFFFAOYSA-N
Mol Weight 439.38 g/mol
Molecular Formula C25H13NO7
Exact Mass 439.069202 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DSTAwOvzAZ0
Name 3,3'-(p-Nitrobenzylidene)-4,5'-epoxy-dicoumarin
Alternate Name(s) 4-Nitrobenzylidene-3,3'-[4,4'-(epoxydicoumarin)] 3,3'-(4-Nitrobenzylidene)-4,4'-epoxydicoumarin 7-(4-nitrophenyl)-6H-pyrano[3,2-c:5,6-c']dichromene-6,8(7H)-dione
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Formula C25H13NO7
InChI InChI=1S/C25H13NO7/c27-24-20-19(13-9-11-14(12-10-13)26(29)30)21-23(16-6-2-4-8-18(16)32-25(21)28)33-22(20)15-5-1-3-7-17(15)31-24/h1-12,19H
InChIKey DQLZBTZWNOPDIW-UHFFFAOYSA-N
Molecular Weight 439.379 g/mol
SMILES C12=C(OC3=C(C2c2ccc(N(=O)=O)cc2)C(Oc2ccccc32)=O)c2ccccc2OC1=O
SPLASH splash10-014i-0009100000-b5f8865a80af891386af
Source of Spectrum D8-332-247-8
Wiley ID 1550689