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1-methyl-5-({2-oxo-2-[3-(phenylsulfonyl)-1-imidazolidinyl]ethyl}sulfanyl)-1H-tetraazole
SpectraBase Compound ID LjDo8ZdzuCl
InChI InChI=1S/C13H16N6O3S2/c1-17-13(14-15-16-17)23-9-12(20)18-7-8-19(10-18)24(21,22)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3
InChIKey OKMRMWNTULKXHW-UHFFFAOYSA-N
Mol Weight 368.43 g/mol
Molecular Formula C13H16N6O3S2
Exact Mass 368.072531 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2Oxsac5kuCV
Name 1-methyl-5-({2-oxo-2-[3-(phenylsulfonyl)-1-imidazolidinyl]ethyl}sulfanyl)-1H-tetraazole
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/C13H16N6O3S2/c1-17-13(14-15-16-17)23-9-12(20)18-7-8-19(10-18)24(21,22)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3
InChIKey OKMRMWNTULKXHW-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31915
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: 1843525; SBI_ID: SBI-031919
Synonyms 1-methyl-1H-tetraazol-5-yl 2-oxo-2-[3-(phenylsulfonyl)-1-imidazolidinyl]ethyl sulfide
Temperature 308 °C