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Methyl-4-[7-(4-chlorophenyl)3-methyl-5-oxo-4,5,6,7,8,9-hexahydroisoxazolo[5,4-b]quinolin4-yl)benzoate
SpectraBase Compound ID AAcXjenNroU
InChI InChI=1S/C25H21ClN2O4/c1-13-21-22(15-3-5-16(6-4-15)25(30)31-2)23-19(27-24(21)32-28-13)11-17(12-20(23)29)14-7-9-18(26)10-8-14/h3-10,17,22,27H,11-12H2,1-2H3
InChIKey DMOJYYSNYXAHLQ-UHFFFAOYSA-N
Mol Weight 448.91 g/mol
Molecular Formula C25H21ClN2O4
Exact Mass 448.118985 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bi0I1GQLvHi
Name Methyl-4-[7-(4-chlorophenyl)3-methyl-5-oxo-4,5,6,7,8,9-hexahydroisoxazolo[5,4-b]quinolin4-yl)benzoate
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21ClN2O4
InChI InChI=1S/C25H21ClN2O4/c1-13-21-22(15-3-5-16(6-4-15)25(30)31-2)23-19(27-24(21)32-28-13)11-17(12-20(23)29)14-7-9-18(26)10-8-14/h3-10,17,22,27H,11-12H2,1-2H3
InChIKey DMOJYYSNYXAHLQ-UHFFFAOYSA-N
Instrument Name GC-MS Varian 1200L
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.093
Molecular Weight 448.906 g/mol
SMILES N1c2c(C(C3=C1CC(CC3=O)c1ccc(Cl)cc1)c1ccc(cc1)C(OC)=O)c(no2)C
SPLASH splash10-000i-1129000000-d426bdefaf2b99ec5aed
Source of Spectrum ARK-2013-355-4y
Wiley ID 1853590