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3-({[5-(2-thienyl)-1,3,4-thiadiazol-2-yl]amino}carbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
SpectraBase Compound ID 1PJ0m6JD4Ih
InChI InChI=1S/C14H13N3O4S2/c18-11(9-6-3-4-7(21-6)10(9)13(19)20)15-14-17-16-12(23-14)8-2-1-5-22-8/h1-2,5-7,9-10H,3-4H2,(H,19,20)(H,15,17,18)/t6-,7+,9+,10+/m0/s1
InChIKey JYPQZYQUXBGJAJ-MVHNUAHISA-N
Mol Weight 351.4 g/mol
Molecular Formula C14H13N3O4S2
Exact Mass 351.034748 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6fEAUSnCtHo
Name 3-({[5-(2-thienyl)-1,3,4-thiadiazol-2-yl]amino}carbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
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/C14H13N3O4S2/c18-11(9-6-3-4-7(21-6)10(9)13(19)20)15-14-17-16-12(23-14)8-2-1-5-22-8/h1-2,5-7,9-10H,3-4H2,(H,19,20)(H,15,17,18)/t6-,7+,9+,10+/m0/s1
InChIKey JYPQZYQUXBGJAJ-MVHNUAHISA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_19386
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: UZI/9141336; UBI_ID: UBI-019390
Temperature 318 °C