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1,1,3,3-Tetramethyl-4'-phenyl-spiro[indane-2,2'-(1,3)oxathiolane]
SpectraBase Compound ID IhAViZSRnTf
InChI InChI=1S/C21H24OS/c1-19(2)16-12-8-9-13-17(16)20(3,4)21(19)22-14-18(23-21)15-10-6-5-7-11-15/h5-13,18H,14H2,1-4H3
InChIKey MUPSZPGATQLCEU-UHFFFAOYSA-N
Mol Weight 324.48 g/mol
Molecular Formula C21H24OS
Exact Mass 324.154787 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DltjUwyR43
Name 1,1,3,3-Tetramethyl-4'-phenyl-spiro[indane-2,2'-(1,3)oxathiolane]
Comments Computed using HOSE algorithm
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Exact Mass 324.154786566 u
Formula C21H24OS
InChI InChI=1S/C21H24OS/c1-19(2)16-12-8-9-13-17(16)20(3,4)21(19)22-14-18(23-21)15-10-6-5-7-11-15/h5-13,18H,14H2,1-4H3
InChIKey MUPSZPGATQLCEU-UHFFFAOYSA-N
Molecular Weight 324.482 g/mol
SMILES C12(SC(C=3C=CC=CC3)CO1)C(C=1C=CC=CC1C2(C)C)(C)C