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2-(.alpha.-Isopropoxybenzyl)-1,3-benzothiazole
SpectraBase Compound ID BIuVi2U8Tiv
InChI InChI=1S/C17H17NOS/c1-12(2)19-16(13-8-4-3-5-9-13)17-18-14-10-6-7-11-15(14)20-17/h3-12,16H,1-2H3
InChIKey UYRPFXMHTVBKCZ-UHFFFAOYSA-N
Mol Weight 283.39 g/mol
Molecular Formula C17H17NOS
Exact Mass 283.103085 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KUiqDz3PSgn
Name 2-(.alpha.-Isopropoxybenzyl)-1,3-benzothiazole
Comments Computed using HOSE algorithm
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Exact Mass 283.103085344 u
Formula C17H17NOS
InChI InChI=1S/C17H17NOS/c1-12(2)19-16(13-8-4-3-5-9-13)17-18-14-10-6-7-11-15(14)20-17/h3-12,16H,1-2H3
InChIKey UYRPFXMHTVBKCZ-UHFFFAOYSA-N
SMILES C1(=NC2=CC=CC=C2S1)C(OC(C)C)C=1C=CC=CC1