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5H-[1,2,4]triazino[5,6-b]indole, 3-[[2-(4-morpholinyl)-2-oxoethyl]thio]-

View entire compound with spectra: 2 NMR

5H-[1,2,4]triazino[5,6-b]indole, 3-[[2-(4-morpholinyl)-2-oxoethyl]thio]-
SpectraBase Compound ID GLvgUlbxWlh
InChI InChI=1S/C15H15N5O2S/c21-12(20-5-7-22-8-6-20)9-23-15-17-14-13(18-19-15)10-3-1-2-4-11(10)16-14/h1-4H,5-9H2,(H,16,17,19)
InChIKey OOXUQOPRDRBRNH-UHFFFAOYSA-N
Mol Weight 329.38 g/mol
Molecular Formula C15H15N5O2S
Exact Mass 329.094646 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IxTYrxWgWIw
Name 5H-[1,2,4]Triazino[5,6-B]indole, 3-[[2-(4-morpholinyl)-2-oxoethyl]thio]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.094645915 u
Formula C15H15N5O2S
InChI InChI=1S/C15H15N5O2S/c21-12(20-5-7-22-8-6-20)9-23-15-17-14-13(18-19-15)10-3-1-2-4-11(10)16-14/h1-4H,5-9H2,(H,16,17,19)
InChIKey OOXUQOPRDRBRNH-UHFFFAOYSA-N
Molecular Weight 329.378 g/mol
SMILES N1C=2C=CC=CC2C2=C1N=C(N=N2)SCC(N1CCOCC1)=O