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1H-pyrimido[5,4-b]indole-3-pentanamide, N-(2,2-dimethoxyethyl)-2,3,4,5-tetrahydro-8-methoxy-4-oxo-2-thioxo-
SpectraBase Compound ID CZjdUsjmPWE
InChI InChI=1S/C20H26N4O5S/c1-27-12-7-8-14-13(10-12)17-18(22-14)19(26)24(20(30)23-17)9-5-4-6-15(25)21-11-16(28-2)29-3/h7-8,10,16,22H,4-6,9,11H2,1-3H3,(H,21,25)(H,23,30)
InChIKey FXSOOGXEMQIYIQ-UHFFFAOYSA-N
Mol Weight 434.51 g/mol
Molecular Formula C20H26N4O5S
Exact Mass 434.162391 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 60Os2JDq5Fi
Name 1H-pyrimido[5,4-b]indole-3-pentanamide, N-(2,2-dimethoxyethyl)-2,3,4,5-tetrahydro-8-methoxy-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 434.162391122 u
Formula C20H26N4O5S
InChI InChI=1S/C20H26N4O5S/c1-27-12-7-8-14-13(10-12)17-18(22-14)19(26)24(20(30)23-17)9-5-4-6-15(25)21-11-16(28-2)29-3/h7-8,10,16,22H,4-6,9,11H2,1-3H3,(H,21,25)(H,23,30)
InChIKey FXSOOGXEMQIYIQ-UHFFFAOYSA-N
Molecular Weight 434.511 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6495
Solvent DMSO-d6
Source Vendor ID: NMR/13289733