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Floctafenine

View entire compound with spectra: 16 MS (GC)

Floctafenine
SpectraBase Compound ID LwUIT9E3UMa
InChI InChI=1S/C20H17F3N2O4/c21-20(22,23)15-6-3-5-13-17(8-9-24-18(13)15)25-16-7-2-1-4-14(16)19(28)29-11-12(27)10-26/h1-9,12,26-27H,10-11H2,(H,24,25)
InChIKey APQPGQGAWABJLN-UHFFFAOYSA-N
Mol Weight 406.36 g/mol
Molecular Formula C20H17F3N2O4
Exact Mass 406.114042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KAB5niFg8RE
Name Benzoic acid, 2-[[8-(trifluoromethyl)-4-quinolinyl]amino]-, 2,3-dihydroxypropyl ester
Alternate Name(s) 2,3-bis(oxidanyl)propyl 2-[[8-(trifluoromethyl)quinolin-4-yl]amino]benzoate 2,3-Dihydroxypropyl 2-[[8-(trifluoromethyl)-4-quinolyl]amino]benzoate 2,3-Dihydroxypropyl 2-[[8-(trifluoromethyl)quinolin-4-yl]amino]benzoate 2,3-Dihydroxypropyl N-(8-(trifluoromethyl)-4-quinolyl)anthranilate 2-(8'-Trifluoromethyl-4'-quinolylamino)benzoic acid 2,3-dihydroxy propyl ester 2-[[8-(trifluoromethyl)-4-quinolinyl]amino]benzoic acid 2,3-dihydroxypropyl ester 2-[[8-(trifluoromethyl)-4-quinolyl]amino]benzoic acid glyceryl ester 4-(o-(2',3'-Dihydroxypropyloxycarbonyl)phenyl)-amino-8-trifluoromethylquinoline 8-Trifluoromethyl-7-deschloroglafenine Benzoic acid, 2-((8-(trifluoromethyl)-4-quinolinyl)amino)-, 2,3-dihydroxypropyl ester Benzoic acid, 2-(8'-trifluoromethyl-4'-quinolylamino)-, 2,3-dihydroxypropyl ester Diralgan Floctafenin Floctafenina Floctafenine Floctafeninum Idarac Novodolan BRN 0457808 EINECS 245-881-4 R 4318 RU 15750
CAS Registry Number 23779-99-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17F3N2O4
InChI InChI=1S/C20H17F3N2O4/c21-20(22,23)15-6-3-5-13-17(8-9-24-18(13)15)25-16-7-2-1-4-14(16)19(28)29-11-12(27)10-26/h1-9,12,26-27H,10-11H2,(H,24,25)
InChIKey APQPGQGAWABJLN-UHFFFAOYSA-N
Molecular Weight 406.361 g/mol
SMILES OCC(COC(c1c(Nc2ccnc3c2cccc3C(F)(F)F)cccc1)=O)O
SPLASH splash10-000b-1289000000-b52599d98433e6fa1d04
Wiley ID 1507798