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sodium S-(2-{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}-2-oxoethyl) thiosulfate
SpectraBase Compound ID 527qrZKS17y
InChI InChI=1S/C13H16N2O5S2.Na/c1-20-10-2-3-12-11(6-10)9(7-15-12)4-5-14-13(16)8-21-22(17,18)19;/h2-3,6-7,15H,4-5,8H2,1H3,(H,14,16)(H,17,18,19);/q;+1/p-1
InChIKey QFGAGUPOCDEOPS-UHFFFAOYSA-M
Mol Weight 366.38 g/mol
Molecular Formula C13H15N2NaO5S2
Exact Mass 366.032008 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A7TwlVK29rN
Name sodium S-(2-{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}-2-oxoethyl) thiosulfate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H16N2O5S2.Na/c1-20-10-2-3-12-11(6-10)9(7-15-12)4-5-14-13(16)8-21-22(17,18)19;/h2-3,6-7,15H,4-5,8H2,1H3,(H,14,16)(H,17,18,19);/q;+1/p-1
InChIKey QFGAGUPOCDEOPS-UHFFFAOYSA-M
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28919
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D90459; Labnumber: PRZHI-0076; SBI_ID: SBI-028923
Temperature 303 °C