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5H-[1,2,4]triazino[5,6-b]indole, 3-[[(2-fluorophenyl)methyl]thio]-
SpectraBase Compound ID LEn4p91VtNA
InChI InChI=1S/C16H11FN4S/c17-12-7-3-1-5-10(12)9-22-16-19-15-14(20-21-16)11-6-2-4-8-13(11)18-15/h1-8H,9H2,(H,18,19,21)
InChIKey QNUGNKKDQJAHSA-UHFFFAOYSA-N
Mol Weight 310.35 g/mol
Molecular Formula C16H11FN4S
Exact Mass 310.068846 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5xC9Eav9t0c
Name 5H-[1,2,4]triazino[5,6-b]indole, 3-[[(2-fluorophenyl)methyl]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 310.068845707 u
Formula C16H11FN4S
InChI InChI=1S/C16H11FN4S/c17-12-7-3-1-5-10(12)9-22-16-19-15-14(20-21-16)11-6-2-4-8-13(11)18-15/h1-8H,9H2,(H,18,19,21)
InChIKey QNUGNKKDQJAHSA-UHFFFAOYSA-N
Molecular Weight 310.350 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17626
Solvent DMSO-d6
Source Vendor ID: NMR/11240307; Lab Info: SAD; Lab Number: 5