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3-([2-(1-Piperidinyl)ethyl]sulfanyl)-5H-[1,2,4]triazino[5,6-b]indole
SpectraBase Compound ID EFx7tuRzcy1
InChI InChI=1S/C16H19N5S/c1-4-8-21(9-5-1)10-11-22-16-18-15-14(19-20-16)12-6-2-3-7-13(12)17-15/h2-3,6-7H,1,4-5,8-11H2,(H,17,18,20)
InChIKey DRVRCPIXTBQSMC-UHFFFAOYSA-N
Mol Weight 313.42 g/mol
Molecular Formula C16H19N5S
Exact Mass 313.136117 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7j8Z5lCJrRl
Name 5H-[1,2,4]triazino[5,6-b]indole, 3-[[2-(1-piperidinyl)ethyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 313.136116806 u
Formula C16H19N5S
InChI InChI=1S/C16H19N5S/c1-4-8-21(9-5-1)10-11-22-16-18-15-14(19-20-16)12-6-2-3-7-13(12)17-15/h2-3,6-7H,1,4-5,8-11H2,(H,17,18,20)
InChIKey DRVRCPIXTBQSMC-UHFFFAOYSA-N
Molecular Weight 313.423 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1704
Solvent DMSO-d6
Source Vendor ID: ZI/8156911; Lab Info: L-23,Kulikova; Lab Number: L-23/0006245