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1-cyclopropyl-6-fluoranyl-7-[(4-methoxyphenyl)methylamino]-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid
SpectraBase Compound ID 1S4LnUU3pZU
InChI InChI=1S/C22H21FN2O4/c1-12-19-18(25(14-5-6-14)11-16(21(19)26)22(27)28)9-17(20(12)23)24-10-13-3-7-15(29-2)8-4-13/h3-4,7-9,11,14,24H,5-6,10H2,1-2H3,(H,27,28)
InChIKey QPZOAWIVNVBQSJ-UHFFFAOYSA-N
Mol Weight 396.42 g/mol
Molecular Formula C22H21FN2O4
Exact Mass 396.148535 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2fYDAMxNRzg
Name 1-cyclopropyl-6-fluoranyl-7-[(4-methoxyphenyl)methylamino]-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid
Alternate Name(s) 1-cyclopropyl-6-fluoro-4-keto-5-methyl-7-(p-anisylamino)quinoline-3-carboxylic acid 1-cyclopropyl-6-fluoro-7-[(4-methoxyphenyl)methylamino]-5-methyl-4-oxo-3-quinolinecarboxylic acid 1-cyclopropyl-6-fluoro-7-[(4-methoxyphenyl)methylamino]-5-methyl-4-oxo-quinoline-3-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21FN2O4
InChI InChI=1S/C22H21FN2O4/c1-12-19-18(25(14-5-6-14)11-16(21(19)26)22(27)28)9-17(20(12)23)24-10-13-3-7-15(29-2)8-4-13/h3-4,7-9,11,14,24H,5-6,10H2,1-2H3,(H,27,28)
InChIKey QPZOAWIVNVBQSJ-UHFFFAOYSA-N
Molecular Weight 396.418 g/mol
SMILES N(c1c(c(c2c(N(C=C(C(=O)O)C2=O)C2CC2)c1)C)F)Cc1ccc(cc1)OC
SPLASH splash10-00di-2902000000-a4111d1fa3f45efadb76
Source of Spectrum E1-43-2250-10
Wiley ID 1553165