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(Stearoylamino)acetic acid, tms
SpectraBase Compound ID EztSc9cE5Ev
InChI InChI=1S/C23H47NO3Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(25)24-21-23(26)27-28(2,3)4/h5-21H2,1-4H3,(H,24,25)
InChIKey VCHMUSLUULEKJU-UHFFFAOYSA-N
Mol Weight 413.7 g/mol
Molecular Formula C23H47NO3Si
Exact Mass 413.332521 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KxPKDSJjdp
Name (Stearoylamino)acetic acid, tms
Comments Computed using HOSE algorithm
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Exact Mass 413.332520909 u
Formula C23H47NO3Si
InChI InChI=1S/C23H47NO3Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(25)24-21-23(26)27-28(2,3)4/h5-21H2,1-4H3,(H,24,25)
InChIKey VCHMUSLUULEKJU-UHFFFAOYSA-N
Molecular Weight 413.718 g/mol
SMILES C(CC(NCC(O[Si](C)(C)C)=O)=O)CCCCCCCCCCCCCCC