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5-ANILINO-2-METHYL-3-OXO-DELTA-4-1,2,4-THIADIAZOLINE
SpectraBase Compound ID F0YiQGINXFm
InChI InChI=1S/C9H9N3OS/c1-12-9(13)11-8(14-12)10-7-5-3-2-4-6-7/h2-6H,1H3,(H,10,11,13)
InChIKey NNTDKMAWVMISLL-UHFFFAOYSA-N
Mol Weight 207.25 g/mol
Molecular Formula C9H9N3OS
Exact Mass 207.046633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EWgIqU7y1bT
Name 5-ANILINO-2-METHYL-3-OXO-DELTA-4-1,2,4-THIADIAZOLINE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9N3OS
InChI InChI=1S/C9H9N3OS/c1-12-9(13)11-8(14-12)10-7-5-3-2-4-6-7/h2-6H,1H3,(H,10,11,13)
InChIKey NNTDKMAWVMISLL-UHFFFAOYSA-N
Literature Reference Author G.L'ABBE,E.ALBRECHT,S.TOPPET
Literature Reference Citation J.HETCYCL.CHEM.,28,1619(1991)
Literature Reference DOI 10.1002/jhet.5570280627
Molecular Weight 207.250 g/mol
Solvent DMSO-D6
Source File Reference UWCP3581