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methyl 3-{[(allylamino)carbothioyl]amino}-6-methoxy-1H-indole-2-carboxylate
SpectraBase Compound ID EiufB5AZ4cS
InChI InChI=1S/C15H17N3O3S/c1-4-7-16-15(22)18-12-10-6-5-9(20-2)8-11(10)17-13(12)14(19)21-3/h4-6,8,17H,1,7H2,2-3H3,(H2,16,18,22)
InChIKey BGPBOODVWZBLTN-UHFFFAOYSA-N
Mol Weight 319.38 g/mol
Molecular Formula C15H17N3O3S
Exact Mass 319.099063 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GOsgCXW8VgZ
Name methyl 3-{[(allylamino)carbothioyl]amino}-6-methoxy-1H-indole-2-carboxylate
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/C15H17N3O3S/c1-4-7-16-15(22)18-12-10-6-5-9(20-2)8-11(10)17-13(12)14(19)21-3/h4-6,8,17H,1,7H2,2-3H3,(H2,16,18,22)
InChIKey BGPBOODVWZBLTN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_19477
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: D13789; Labnumber: SIMAK-01308; SBI_ID: SBI-019480
Temperature 318 °C