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3-(4-Benzyl-piperazine-1-carbonyl)-6,8-dichloro-chromen-2-one
SpectraBase Compound ID AAmC3PWVqnR
InChI InChI=1S/C21H18Cl2N2O3/c22-16-10-15-11-17(21(27)28-19(15)18(23)12-16)20(26)25-8-6-24(7-9-25)13-14-4-2-1-3-5-14/h1-5,10-12H,6-9,13H2
InChIKey QRXSMQGKZYZGNU-UHFFFAOYSA-N
Mol Weight 417.29 g/mol
Molecular Formula C21H18Cl2N2O3
Exact Mass 416.069448 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8p1yYQgu4lY
Name 3-(4-Benzyl-piperazine-1-carbonyl)-6,8-dichloro-chromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18Cl2N2O3
InChI InChI=1S/C21H18Cl2N2O3/c22-16-10-15-11-17(21(27)28-19(15)18(23)12-16)20(26)25-8-6-24(7-9-25)13-14-4-2-1-3-5-14/h1-5,10-12H,6-9,13H2
InChIKey QRXSMQGKZYZGNU-UHFFFAOYSA-N
Molecular Weight 417.292 g/mol
SMILES C=1(C(Oc2c(cc(cc2C1)Cl)Cl)=O)C(N1CCN(Cc2ccccc2)CC1)=O
SPLASH splash10-0006-9810000000-7f2753386804b28ca1a8
Synonyms 3-(4-benzylpiperazine-1-carbonyl)-6,8-dichloro-coumarin 6,8-bis(chloranyl)-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-chromen-2-one 6,8-Dichloro-3-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-1-benzopyran-2-one 3-(4-benzylpiperazine-1-carbonyl)-6,8-dichlorochromen-2-one
Wiley ID 1444472