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ethyl {[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]amino}(oxo)acetate
SpectraBase Compound ID FV5RLuKwVnG
InChI InChI=1S/C12H12N2O5S2/c1-3-19-11(16)10(15)14-12-13-8-5-4-7(21(2,17)18)6-9(8)20-12/h4-6H,3H2,1-2H3,(H,13,14,15)
InChIKey KBNQLTZCXDZVMW-UHFFFAOYSA-N
Mol Weight 328.36 g/mol
Molecular Formula C12H12N2O5S2
Exact Mass 328.018764 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2SoMaAQ60vN
Name ethyl {[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]amino}(oxo)acetate
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/C12H12N2O5S2/c1-3-19-11(16)10(15)14-12-13-8-5-4-7(21(2,17)18)6-9(8)20-12/h4-6H,3H2,1-2H3,(H,13,14,15)
InChIKey KBNQLTZCXDZVMW-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6566
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: 62922; UBI_ID: UBI-006568
Temperature 313 °C