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7-(3-Amino-1-pyrrolidinyl)-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-8-(trifluoromethyl)-3-quinolinecarboxylic acid
SpectraBase Compound ID f6udNVB6n7
InChI InChI=1S/C18H17F4N3O3/c19-12-5-10-14(25(9-1-2-9)7-11(16(10)26)17(27)28)13(18(20,21)22)15(12)24-4-3-8(23)6-24/h5,7-9H,1-4,6,23H2,(H,27,28)
InChIKey LHFGKSNSZPZEPC-UHFFFAOYSA-N
Mol Weight 399.35 g/mol
Molecular Formula C18H17F4N3O3
Exact Mass 399.120604 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 202y7xkodLY
Name 7-(3-Amino-1-pyrrolidinyl)-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-8-(trifluoromethyl)-3-quinolinecarboxylic acid
Alternate Name(s) 7-(3-amino-1-pyrrolidinyl)-1-cyclopropyl-6-fluoro-4-oxo-8-(trifluoromethyl)-3-quinolinecarboxylic acid 7-(3-aminopyrrolidin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid 7-(3-aminopyrrolidino)-1-cyclopropyl-6-fluoro-4-keto-8-(trifluoromethyl)quinoline-3-carboxylic acid 7-(3-azanylpyrrolidin-1-yl)-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-8-(trifluoromethyl)quinoline-3-carboxylic acid
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17F4N3O3
InChI InChI=1S/C18H17F4N3O3/c19-12-5-10-14(25(9-1-2-9)7-11(16(10)26)17(27)28)13(18(20,21)22)15(12)24-4-3-8(23)6-24/h5,7-9H,1-4,6,23H2,(H,27,28)
InChIKey LHFGKSNSZPZEPC-UHFFFAOYSA-N
Molecular Weight 399.346 g/mol
SMILES NC1CN(c2c(cc3c(N(C=C(C(=O)O)C3=O)C3CC3)c2C(F)(F)F)F)CC1
SPLASH splash10-0002-0009200000-5ddec344870caf87c518
Source of Spectrum F2-35-366-17
Wiley ID 1574241