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Monocyclohexyl phthalate, tms derivative
SpectraBase Compound ID 7pIPCx26hxr
InChI InChI=1S/C17H24O4Si/c1-22(2,3)21-17(19)15-12-8-7-11-14(15)16(18)20-13-9-5-4-6-10-13/h7-8,11-13H,4-6,9-10H2,1-3H3
InChIKey VAYGBFOLOUESCU-UHFFFAOYSA-N
Mol Weight 320.46 g/mol
Molecular Formula C17H24O4Si
Exact Mass 320.144386 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LQol1N8xOpP
Name Monocyclohexyl phthalate, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 320.144385784 u
Formula C17H24O4Si
InChI InChI=1S/C17H24O4Si/c1-22(2,3)21-17(19)15-12-8-7-11-14(15)16(18)20-13-9-5-4-6-10-13/h7-8,11-13H,4-6,9-10H2,1-3H3
InChIKey VAYGBFOLOUESCU-UHFFFAOYSA-N
Molecular Weight 320.460 g/mol
SMILES C1=CC=CC(=C1C(=O)OC1CCCCC1)C(=O)O[Si](C)(C)C