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Cyclohexanespiro-4'-(5'-methylene-2'-benzylimino-1',3'-thiazolidine)
SpectraBase Compound ID Gu9oqCIPDUi
InChI InChI=1S/C16H20N2S/c1-13-16(10-6-3-7-11-16)18-15(19-13)17-12-14-8-4-2-5-9-14/h2,4-5,8-9H,1,3,6-7,10-12H2,(H,17,18)
InChIKey VCYINHOROHOHJN-UHFFFAOYSA-N
Mol Weight 272.41 g/mol
Molecular Formula C16H20N2S
Exact Mass 272.13472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EzWm5SOJlTo
Name Cyclohexanespiro-4'-(5'-methylene-2'-benzylimino-1',3'-thiazolidine)
Comments Computed using HOSE algorithm
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Exact Mass 272.134719826 u
Formula C16H20N2S
InChI InChI=1S/C16H20N2S/c1-13-16(10-6-3-7-11-16)18-15(19-13)17-12-14-8-4-2-5-9-14/h2,4-5,8-9H,1,3,6-7,10-12H2,(H,17,18)
InChIKey VCYINHOROHOHJN-UHFFFAOYSA-N
Molecular Weight 272.410 g/mol
SMILES C1C2(N\C(=N/CC=3C=CC=CC3)SC2=C)CCCC1