For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5H-[1,2,4]triazino[5,6-b]indole-5-acetic acid, 3-[[(2-fluorophenyl)methyl]thio]-
SpectraBase Compound ID 7rxcr2owHcQ
InChI InChI=1S/C18H13FN4O2S/c19-13-7-3-1-5-11(13)10-26-18-20-17-16(21-22-18)12-6-2-4-8-14(12)23(17)9-15(24)25/h1-8H,9-10H2,(H,24,25)
InChIKey GHEWKRUZAFYTPN-UHFFFAOYSA-N
Mol Weight 368.39 g/mol
Molecular Formula C18H13FN4O2S
Exact Mass 368.074325 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9uV4srJ9X99
Name 5H-[1,2,4]triazino[5,6-b]indole-5-acetic acid, 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 368.074325010 u
Formula C18H13FN4O2S
InChI InChI=1S/C18H13FN4O2S/c19-13-7-3-1-5-11(13)10-26-18-20-17-16(21-22-18)12-6-2-4-8-14(12)23(17)9-15(24)25/h1-8H,9-10H2,(H,24,25)
InChIKey GHEWKRUZAFYTPN-UHFFFAOYSA-N
Molecular Weight 368.386 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14651
Solvent DMSO-d6
Source Vendor ID: NMR/10310670; Lab Info: SAD; Lab Number: 100