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1H-pyrimido[5,4-b]indole-5-acetamide, N-(4-ethoxyphenyl)-2,3,4,5-tetrahydro-8-methoxy-3-methyl-4-oxo-2-thioxo-
SpectraBase Compound ID GAaRHs8BTIW
InChI InChI=1S/C22H22N4O4S/c1-4-30-14-7-5-13(6-8-14)23-18(27)12-26-17-10-9-15(29-3)11-16(17)19-20(26)21(28)25(2)22(31)24-19/h5-11H,4,12H2,1-3H3,(H,23,27)(H,24,31)
InChIKey RNODTKIRGCYQCF-UHFFFAOYSA-N
Mol Weight 438.5 g/mol
Molecular Formula C22H22N4O4S
Exact Mass 438.136176 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LJlnDVe63UO
Name 1H-pyrimido[5,4-b]indole-5-acetamide, N-(4-ethoxyphenyl)-2,3,4,5-tetrahydro-8-methoxy-3-methyl-4-oxo-2-thioxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.136176374 u
Formula C22H22N4O4S
InChI InChI=1S/C22H22N4O4S/c1-4-30-14-7-5-13(6-8-14)23-18(27)12-26-17-10-9-15(29-3)11-16(17)19-20(26)21(28)25(2)22(31)24-19/h5-11H,4,12H2,1-3H3,(H,23,27)(H,24,31)
InChIKey RNODTKIRGCYQCF-UHFFFAOYSA-N
Molecular Weight 438.502 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3288
Solvent DMSO-d6
Source Vendor ID: NMR/13278861