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4-(Cyclohexyloxy)-4-oxobutanoic acid, tms derivative
SpectraBase Compound ID 8u9XBuEWRSL
InChI InChI=1S/C13H24O4Si/c1-18(2,3)17-13(15)10-9-12(14)16-11-7-5-4-6-8-11/h11H,4-10H2,1-3H3
InChIKey MRWRCRZKPMRPTK-UHFFFAOYSA-N
Mol Weight 272.42 g/mol
Molecular Formula C13H24O4Si
Exact Mass 272.144386 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5i7n8W5ZiTz
Name 4-(Cyclohexyloxy)-4-oxobutanoic acid, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 272.144385784 u
Formula C13H24O4Si
InChI InChI=1S/C13H24O4Si/c1-18(2,3)17-13(15)10-9-12(14)16-11-7-5-4-6-8-11/h11H,4-10H2,1-3H3
InChIKey MRWRCRZKPMRPTK-UHFFFAOYSA-N
Molecular Weight 272.416 g/mol
SMILES C1(OC(=O)CCC(=O)O[Si](C)(C)C)CCCCC1