For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
S-[1-(4-METHYLPHENYL)-1-(3-MORPHOLINYLUREIDO)-2,2,2-TRIFLUOROETHYL]-O-METHYL(4-METHOXYPHENYL)ISOTHIOURETHANE
SpectraBase Compound ID BWjT5mG0kXT
InChI InChI=1S/C23H26F3N3O4S/c1-16-4-6-17(7-5-16)22(23(24,25)26,28-20(30)29-12-14-33-15-13-29)34-21(32-3)27-18-8-10-19(31-2)11-9-18/h4-11H,12-15H2,1-3H3,(H,28,30)/b27-21+
InChIKey SNXPSRUCWCILEV-SZXQPVLSSA-N
Mol Weight 497.53 g/mol
Molecular Formula C23H26F3N3O4S
Exact Mass 497.159612 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2sR1r2a0mQ
Name S-[1-(4-METHYLPHENYL)-1-(3-MORPHOLINYLUREIDO)-2,2,2-TRIFLUOROETHYL]-O-METHYL(4-METHOXYPHENYL)ISOTHIOURETHANE
Comments SCALE INVERTED;WP-200 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H26F3N3O4S
InChI InChI=1S/C23H26F3N3O4S/c1-16-4-6-17(7-5-16)22(23(24,25)26,28-20(30)29-12-14-33-15-13-29)34-21(32-3)27-18-8-10-19(31-2)11-9-18/h4-11H,12-15H2,1-3H3,(H,28,30)/b27-21+
InChIKey SNXPSRUCWCILEV-SZXQPVLSSA-N
Instrument Name SEE COMMENT
Literature Reference M.V.VOVK, YU.N.DAVIDYUK, A.N.CHERNEGA, I.F.TSYMBAL, L.I.SAMARAI (1992)Zhurn.Org.Khim.(Russ. Lang.): v.28, N10, 2042-2053.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6