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5-fluoro ABICA
SpectraBase Compound ID 35KJBt255JL
InChI InChI=1S/C19H26FN3O2/c1-13(2)17(18(21)24)22-19(25)15-12-23(11-7-3-6-10-20)16-9-5-4-8-14(15)16/h4-5,8-9,12-13,17H,3,6-7,10-11H2,1-2H3,(H2,21,24)(H,22,25)/t17-/m1/s1
InChIKey GQYZBLMAONPUNX-QGZVFWFLSA-N
Mol Weight 347.43 g/mol
Molecular Formula C19H26FN3O2
Exact Mass 347.200905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID InTJaUWf4Sr
Name 5-Fluoro-ABICA
Alternate Name(s) (S)-N-(1-amino-3-methyl-1-oxobutan-2-yl)-1-(5-fluoropentyl)-1H-indole-3-carboxamide 5F-ABICA (R)-N-(1-amino-3-methyl-1-oxobutan-2-yl)-1-(5-fluoropentyl)-1H-indole-3-carboxamide
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Formula C19H26FN3O2
InChI InChI=1S/C19H26FN3O2/c1-13(2)17(18(21)24)22-19(25)15-12-23(11-7-3-6-10-20)16-9-5-4-8-14(15)16/h4-5,8-9,12-13,17H,3,6-7,10-11H2,1-2H3,(H2,21,24)(H,22,25)/t17-/m1/s1
InChIKey GQYZBLMAONPUNX-QGZVFWFLSA-N
Molecular Weight 347.434 g/mol
SMILES N(C(c1c2ccccc2[n](c1)CCCCCF)=O)[C@@](C(N)=O)(C(C)C)[H]
SPLASH splash10-001i-1490000000-72c12f241457b1354183
Source of Spectrum SWG-33-4243-0
Wiley ID 1810865