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1H-isoindole-1,3(2H)-dione, 2-[3-(5-amino-1,3,4-thiadiazol-2-yl)propyl]-
SpectraBase Compound ID Jf36kMiwpzJ
InChI InChI=1S/C13H12N4O2S/c14-13-16-15-10(20-13)6-3-7-17-11(18)8-4-1-2-5-9(8)12(17)19/h1-2,4-5H,3,6-7H2,(H2,14,16)
InChIKey WHJDTNIXSFPLFF-UHFFFAOYSA-N
Mol Weight 288.32 g/mol
Molecular Formula C13H12N4O2S
Exact Mass 288.068097 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 77vh3qLVpr6
Name 1H-isoindole-1,3(2H)-dione, 2-[3-(5-amino-1,3,4-thiadiazol-2-yl)propyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 288.068096814 u
Formula C13H12N4O2S
InChI InChI=1S/C13H12N4O2S/c14-13-16-15-10(20-13)6-3-7-17-11(18)8-4-1-2-5-9(8)12(17)19/h1-2,4-5H,3,6-7H2,(H2,14,16)
InChIKey WHJDTNIXSFPLFF-UHFFFAOYSA-N
Molecular Weight 288.325 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_529
Solvent DMSO-d6
Source Vendor ID: NMR/13239022