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2-Heptenoic acid, (E)-, tms derivative
SpectraBase Compound ID 8h1tZ3UYeIS
InChI InChI=1S/C10H20O2Si/c1-5-6-7-8-9-10(11)12-13(2,3)4/h8-9H,5-7H2,1-4H3/b9-8+
InChIKey QPKLNSFJIMVOON-CMDGGOBGSA-N
Mol Weight 200.35 g/mol
Molecular Formula C10H20O2Si
Exact Mass 200.123256 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KRAdDRtiwmx
Name 2-Heptenoic acid, (E)-, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 200.123256417 u
Formula C10H20O2Si
InChI InChI=1S/C10H20O2Si/c1-5-6-7-8-9-10(11)12-13(2,3)4/h8-9H,5-7H2,1-4H3/b9-8+
InChIKey QPKLNSFJIMVOON-CMDGGOBGSA-N
Molecular Weight 200.353 g/mol
SMILES CCCC\C=C\C(O[Si](C)(C)C)=O