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2-({2-[(2-amino-2-oxoethyl)sulfanyl]-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl}sulfanyl)acetamide
SpectraBase Compound ID DGB9BdBdt0c
InChI InChI=1S/C14H17N5O2S2/c15-9(20)5-22-13-11-7-3-1-2-4-8(7)17-12(11)18-14(19-13)23-6-10(16)21/h1-6H2,(H2,15,20)(H2,16,21)(H,17,18,19)
InChIKey DVPBAVPDMGASEM-UHFFFAOYSA-N
Mol Weight 351.44 g/mol
Molecular Formula C14H17N5O2S2
Exact Mass 351.082367 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7NMizNYX0mm
Name 2-({2-[(2-amino-2-oxoethyl)sulfanyl]-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indol-4-yl}sulfanyl)acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 351.082367153 u
Formula C14H17N5O2S2
InChI InChI=1S/C14H17N5O2S2/c15-9(20)5-22-13-11-7-3-1-2-4-8(7)17-12(11)18-14(19-13)23-6-10(16)21/h1-6H2,(H2,15,20)(H2,16,21)(H,17,18,19)
InChIKey DVPBAVPDMGASEM-UHFFFAOYSA-N
Molecular Weight 351.443 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1849
Solvent DMSO-d6
Source Vendor ID: NMR/12278536