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2-[(5Z)-4-keto-5-neopentylidene-2-thioxo-thiazolidin-3-yl]acetic acid
SpectraBase Compound ID 76Xl8FMw1g2
InChI InChI=1S/C10H13NO3S2/c1-10(2,3)4-6-8(14)11(5-7(12)13)9(15)16-6/h4H,5H2,1-3H3,(H,12,13)/b6-4-
InChIKey WQRFZOCYSXXOID-XQRVVYSFSA-N
Mol Weight 259.34 g/mol
Molecular Formula C10H13NO3S2
Exact Mass 259.033686 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J1ZYx0wlIsw
Name 2-[(5Z)-4-keto-5-neopentylidene-2-thioxo-thiazolidin-3-yl]acetic acid
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H13NO3S2
InChI InChI=1S/C10H13NO3S2/c1-10(2,3)4-6-8(14)11(5-7(12)13)9(15)16-6/h4H,5H2,1-3H3,(H,12,13)/b6-4-
InChIKey WQRFZOCYSXXOID-XQRVVYSFSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 259.338 g/mol
Source File Reference MHKO21532