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app-Binaca tms
SpectraBase Compound ID IxoY9MLEWo0
InChI InChI=1S/C24H32N4O2Si/c1-5-6-16-28-21-15-11-10-14-19(21)22(27-28)24(29)26-20(23(25)30-31(2,3)4)17-18-12-8-7-9-13-18/h7-15,20,25H,5-6,16-17H2,1-4H3,(H,26,29)/b25-23-
InChIKey GNXOXAYLZGVWCX-BZZOAKBMSA-N
Mol Weight 436.6 g/mol
Molecular Formula C24H32N4O2Si
Exact Mass 436.229453 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K9OSWOzDpoU
Name app-Binaca tms
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 436.229452819 u
Formula C24H32N4O2Si
InChI InChI=1S/C24H32N4O2Si/c1-5-6-16-28-21-15-11-10-14-19(21)22(27-28)24(29)26-20(23(25)30-31(2,3)4)17-18-12-8-7-9-13-18/h7-15,20,25H,5-6,16-17H2,1-4H3,(H,26,29)/b25-23-
InChIKey GNXOXAYLZGVWCX-BZZOAKBMSA-N
Molecular Weight 436.631 g/mol
SMILES C=1(C=2C(N(N1)CCCC)=CC=CC2)C(NC(C(O[Si](C)(C)C)=N)CC=1C=CC=CC1)=O