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5-Hydroxydopamine, tris(tert-butyldimethylsilyl) ether
SpectraBase Compound ID 69GHy331Eq9
InChI InChI=1S/C26H53NO3Si3/c1-24(2,3)31(10,11)28-21-18-20(16-17-27)19-22(29-32(12,13)25(4,5)6)23(21)30-33(14,15)26(7,8)9/h18-19H,16-17,27H2,1-15H3
InChIKey CTHJOHMJPTYVQA-UHFFFAOYSA-N
Mol Weight 512.0 g/mol
Molecular Formula C26H53NO3Si3
Exact Mass 511.333324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HM4EEq09eZg
Name 5-Hydroxydopamine, tris(tert-butyldimethylsilyl) ether
Comments Computed using HOSE algorithm
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Exact Mass 511.333324173 u
Formula C26H53NO3Si3
InChI InChI=1S/C26H53NO3Si3/c1-24(2,3)31(10,11)28-21-18-20(16-17-27)19-22(29-32(12,13)25(4,5)6)23(21)30-33(14,15)26(7,8)9/h18-19H,16-17,27H2,1-15H3
InChIKey CTHJOHMJPTYVQA-UHFFFAOYSA-N
Molecular Weight 511.969 g/mol
SMILES C(N)CC1=CC(O[Si](C)(C)C(C)(C)C)=C(O[Si](C)(C)C(C)(C)C)C(=C1)O[Si](C)(C)C(C)(C)C