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(S)-(+)-6-N-benzylamino-5-(triisopropylsilyloxy)hexyl pivalate
SpectraBase Compound ID C4J9omQ13xP
InChI InChI=1S/C27H49NO3Si/c1-21(2)32(22(3)4,23(5)6)31-25(20-28-19-24-15-11-10-12-16-24)17-13-14-18-30-26(29)27(7,8)9/h10-12,15-16,21-23,25,28H,13-14,17-20H2,1-9H3/t25-/m0/s1
InChIKey ZGYNEEASGBFFFP-VWLOTQADSA-N
Mol Weight 463.8 g/mol
Molecular Formula C27H49NO3Si
Exact Mass 463.348171 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LgDtszr3e8J
Name (S)-(+)-6-N-benzylamino-5-(triisopropylsilyloxy)hexyl pivalate
Comments Computed using HOSE algorithm
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Exact Mass 463.348170974 u
Formula C27H49NO3Si
InChI InChI=1S/C27H49NO3Si/c1-21(2)32(22(3)4,23(5)6)31-25(20-28-19-24-15-11-10-12-16-24)17-13-14-18-30-26(29)27(7,8)9/h10-12,15-16,21-23,25,28H,13-14,17-20H2,1-9H3/t25-/m0/s1
InChIKey ZGYNEEASGBFFFP-VWLOTQADSA-N
Molecular Weight 463.778 g/mol
SMILES [C@](O[Si](C(C)C)(C(C)C)C(C)C)(CNCC=1C=CC=CC1)(CCCCOC(C(C)(C)C)=O)[H]