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[(2E)-2-(cycloheptylidenehydrazono)-4-oxo-1,3-thiazolidin-5-yl]acetic acid

View entire compound with spectra: 2 NMR

[(2E)-2-(cycloheptylidenehydrazono)-4-oxo-1,3-thiazolidin-5-yl]acetic acid
SpectraBase Compound ID 4mDSmHSHYl8
InChI InChI=1S/C12H17N3O3S/c16-10(17)7-9-11(18)13-12(19-9)15-14-8-5-3-1-2-4-6-8/h9H,1-7H2,(H,16,17)(H,13,15,18)
InChIKey IWZBPGBAADIHCO-UHFFFAOYSA-N
Mol Weight 283.35 g/mol
Molecular Formula C12H17N3O3S
Exact Mass 283.099063 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5RJUX3xjM5f
Name [(2E)-2-(Cycloheptylidenehydrazono)-4-oxo-1,3-thiazolidin-5-yl]acetic acid
Comments Computed using HOSE algorithm
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Exact Mass 283.099062590 u
Formula C12H17N3O3S
InChI InChI=1S/C12H17N3O3S/c16-10(17)7-9-11(18)13-12(19-9)15-14-8-5-3-1-2-4-6-8/h9H,1-7H2,(H,16,17)(H,13,15,18)
InChIKey IWZBPGBAADIHCO-UHFFFAOYSA-N
Molecular Weight 283.346 g/mol
SMILES N1C(C(CC(=O)O)S\C1=N/N=C1CCCCCC1)=O