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Dopamine, 3tbdms derivative
SpectraBase Compound ID 1L61GZ7CzU2
InChI InChI=1S/C26H53NO2Si3/c1-24(2,3)30(10,11)27-19-18-21-16-17-22(28-31(12,13)25(4,5)6)23(20-21)29-32(14,15)26(7,8)9/h16-17,20,27H,18-19H2,1-15H3
InChIKey JFRZLRBTNXRJJM-UHFFFAOYSA-N
Mol Weight 496.0 g/mol
Molecular Formula C26H53NO2Si3
Exact Mass 495.33841 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LIcY8DuGreU
Name Dopamine, 3tbdms derivative
Comments Computed using HOSE algorithm
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Exact Mass 495.338409554 u
Formula C26H53NO2Si3
InChI InChI=1S/C26H53NO2Si3/c1-24(2,3)30(10,11)27-19-18-21-16-17-22(28-31(12,13)25(4,5)6)23(20-21)29-32(14,15)26(7,8)9/h16-17,20,27H,18-19H2,1-15H3
InChIKey JFRZLRBTNXRJJM-UHFFFAOYSA-N
Molecular Weight 495.970 g/mol
SMILES C1(=C(C=CC(=C1)CCN[Si](C(C)(C)C)(C)C)O[Si](C(C)(C)C)(C)C)O[Si](C(C)(C)C)(C)C