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1-Cyclohexyl-3-(2,2,2-trifluoroacetyl)-2-oxo-2,3-dihydro-1H-imidazo[2,1-a]isoquinolin-4-ium-3-ide
SpectraBase Compound ID 8xJ2KqQgZgd
InChI InChI=1S/C19H17F3N2O2/c20-19(21,22)16(25)15-18(26)24(13-7-2-1-3-8-13)17-14-9-5-4-6-12(14)10-11-23(15)17/h4-6,9-11,13H,1-3,7-8H2
InChIKey JMKMEOSYKAFTAT-UHFFFAOYSA-N
Mol Weight 362.35 g/mol
Molecular Formula C19H17F3N2O2
Exact Mass 362.124212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOGNSSm1okC
Name 1-Cyclohexyl-3-(2,2,2-trifluoroacetyl)-2-oxo-2,3-dihydro-1H-imidazo[2,1-a]isoquinolin-4-ium-3-ide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17F3N2O2
InChI InChI=1S/C19H17F3N2O2/c20-19(21,22)16(25)15-18(26)24(13-7-2-1-3-8-13)17-14-9-5-4-6-12(14)10-11-23(15)17/h4-6,9-11,13H,1-3,7-8H2
InChIKey JMKMEOSYKAFTAT-UHFFFAOYSA-N
Molecular Weight 362.352 g/mol
SMILES [C-]1([n+]2c(N(C1=O)C1CCCCC1)c1ccccc1cc2)C(C(F)(F)F)=O
SPLASH splash10-03e9-0291000000-15870009cf11c162a0a0
Source of Spectrum U1-2009-622-5l
Synonyms (1Z)-1-(1-cyclohexyl-2-oxo-3-imidazo[2,1-a]isoquinolin-4-iumylidene)-2,2,2-trifluoroethanolate (1Z)-1-(1-cyclohexyl-2-oxoimidazo[2,1-a]isoquinolin-4-ium-3-ylidene)-2,2,2-trifluoroethanolate (1Z)-1-(1-cyclohexyl-2-oxo-imidazo[2,1-a]isoquinolin-4-ium-3-ylidene)-2,2,2-trifluoro-ethanolate (1Z)-1-(1-cyclohexyl-2-oxidanylidene-imidazo[2,1-a]isoquinolin-4-ium-3-ylidene)-2,2,2-tris(fluoranyl)ethanolate
Wiley ID 1662514