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5-ACETYLIMINO-3,3-PENTAMETHYLEN-1,2,4-THIADIAZOLINE

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5-ACETYLIMINO-3,3-PENTAMETHYLEN-1,2,4-THIADIAZOLINE
SpectraBase Compound ID DAmSdkLWM2t
InChI InChI=1S/C9H15N3OS/c1-7(13)10-8-11-9(12-14-8)5-3-2-4-6-9/h12H,2-6H2,1H3,(H,10,11,13)
InChIKey JGGVVWJXSCPGSO-UHFFFAOYSA-N
Mol Weight 213.3 g/mol
Molecular Formula C9H15N3OS
Exact Mass 213.093583 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2gIiwCFrKRh
Name 5-ACETYLIMINO-3,3-PENTAMETHYLEN-1,2,4-THIADIAZOLINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H15N3OS
InChI InChI=1S/C9H15N3OS/c1-7(13)10-8-11-9(12-14-8)5-3-2-4-6-9/h12H,2-6H2,1H3,(H,10,11,13)
InChIKey JGGVVWJXSCPGSO-UHFFFAOYSA-N
Literature Reference Author S.ANDREAE,E.SCHMITZ
Literature Reference Citation J.PRAKT.CHEM.,329,1008(1987)
Literature Reference DOI 10.1002/prac.19873290608
Molecular Weight 213.298 g/mol
Solvent DMSO-D6/HMDS
Source File Reference UWED11390