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(acetyloxy)cuprio acetate 3-{2-[(4-oxo-4H-chromen-3-yl)methylidene]hydrazin-1-ylidene}-2,3-dihydro-1H-indol-2-one hydrate
SpectraBase Compound ID 46AgVLMx3bY
InChI InChI=1S/C18H11N3O3.2C2H4O2.Cu.H2O/c22-17-11(10-24-15-8-4-2-6-13(15)17)9-19-21-16-12-5-1-3-7-14(12)20-18(16)23;2*1-2(3)4;;/h1-10H,(H,20,21,23);2*1H3,(H,3,4);;1H2/q;;;+2;/p-2
InChIKey VIFWWCSJQYPCAY-UHFFFAOYSA-L
Mol Weight 516.953 g/mol
Molecular Formula C22H19CuN3O8
Exact Mass 516.046812 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CNbKxvncCY1
Name (acetyloxy)cuprio acetate 3-{2-[(4-oxo-4H-chromen-3-yl)methylidene]hydrazin-1-ylidene}-2,3-dihydro-1H-indol-2-one hydrate
Appearance Dark brown colour
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H19CuN3O8
InChI InChI=1S/C18H11N3O3.2C2H4O2.Cu.H2O/c22-17-11(10-24-15-8-4-2-6-13(15)17)9-19-21-16-12-5-1-3-7-14(12)20-18(16)23;2*1-2(3)4;;/h1-10H,(H,20,21,23);2*1H3,(H,3,4);;1H2/q;;;+2;/p-2
InChIKey VIFWWCSJQYPCAY-UHFFFAOYSA-L
Instrument Name Thermo Scientific ISQ
Ionization Type EI
Literature Reference DOI 10.1002/aoc.5147
Molecular Weight 516.953 g/mol
SMILES C(O[Cu]OC(C)=O)(=O)C.N1C(C(c2c1cccc2)=NN=CC1=COc2ccccc2C1=O)=O.O
SPLASH splash10-0i30-1944610000-bbd1901b2efac35e3d67
Source of Spectrum AOC-33-7-1
Wiley ID 1838298