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acetamide, 2-[[3-cyano-5,6,7,8-tetrahydro-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-2-quinolinyl]thio]-N-(5-phenyl-1,2,4-thiadiazol-3-yl)-
SpectraBase Compound ID GOQTIKTDcqt
InChI InChI=1S/C29H25N5O3S2/c1-29(2)13-21-25(22(35)14-29)24(17-9-11-19(37-3)12-10-17)20(15-30)27(31-21)38-16-23(36)32-28-33-26(39-34-28)18-7-5-4-6-8-18/h4-12H,13-14,16H2,1-3H3,(H,32,34,36)
InChIKey MGPJKQMOFYTGAW-UHFFFAOYSA-N
Mol Weight 555.67 g/mol
Molecular Formula C29H25N5O3S2
Exact Mass 555.139882 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FqlFFZDqpPK
Name acetamide, 2-[[3-cyano-5,6,7,8-tetrahydro-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-2-quinolinyl]thio]-N-(5-phenyl-1,2,4-thiadiazol-3-yl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 555.139882030 u
Formula C29H25N5O3S2
InChI InChI=1S/C29H25N5O3S2/c1-29(2)13-21-25(22(35)14-29)24(17-9-11-19(37-3)12-10-17)20(15-30)27(31-21)38-16-23(36)32-28-33-26(39-34-28)18-7-5-4-6-8-18/h4-12H,13-14,16H2,1-3H3,(H,32,34,36)
InChIKey MGPJKQMOFYTGAW-UHFFFAOYSA-N
Molecular Weight 555.671 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1636
Solvent DMSO-d6
Source Vendor ID: NMR/13259992