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9-(5-Amino-3-methylisoxazol-4-yl)-7-chloro-3-(4-chlorophenyl)-2,3,4,9-tetrahydro-1Hxanthen-1-one
SpectraBase Compound ID KLL4p7oeuEI
InChI InChI=1S/C23H18Cl2N2O3/c1-11-20(23(26)30-27-11)21-16-10-15(25)6-7-18(16)29-19-9-13(8-17(28)22(19)21)12-2-4-14(24)5-3-12/h2-7,10,13,21H,8-9,26H2,1H3
InChIKey NYGWNWUATVIMLY-UHFFFAOYSA-N
Mol Weight 441.31 g/mol
Molecular Formula C23H18Cl2N2O3
Exact Mass 440.069448 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J1Vb3Ct4WOr
Name 9-(5-Amino-3-methylisoxazol-4-yl)-7-chloro-3-(4-chlorophenyl)-2,3,4,9-tetrahydro-1Hxanthen-1-one
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H18Cl2N2O3
InChI InChI=1S/C23H18Cl2N2O3/c1-11-20(23(26)30-27-11)21-16-10-15(25)6-7-18(16)29-19-9-13(8-17(28)22(19)21)12-2-4-14(24)5-3-12/h2-7,10,13,21H,8-9,26H2,1H3
InChIKey NYGWNWUATVIMLY-UHFFFAOYSA-N
Instrument Name GC-MS Varian 1200L
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.093
Molecular Weight 441.314 g/mol
SMILES Nc1c(c(no1)C)C1c2c(OC3=C1C(CC(C3)c1ccc(cc1)Cl)=O)ccc(c2)Cl
SPLASH splash10-0002-6092000000-137652c62cb5e8d25bb2
Source of Spectrum ARK-2013-361-11l
Wiley ID 1853534