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N-((-)-(1R)-menthoxycarbonxyl)-(S,S)norpseudoephedrine tms
SpectraBase Compound ID JpsTosw8Jj8
InChI InChI=1S/C23H39NO3Si/c1-16(2)20-14-13-17(3)15-21(20)26-23(25)24-18(4)22(27-28(5,6)7)19-11-9-8-10-12-19/h8-12,16-18,20-22H,13-15H2,1-7H3,(H,24,25)/t17-,18+,20+,21-,22-/m1/s1
InChIKey UVEFPEZWBTUNNH-OCFWJZSCSA-N
Mol Weight 405.7 g/mol
Molecular Formula C23H39NO3Si
Exact Mass 405.269921 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ve0qhtFQUY
Name N-((-)-(1R)-menthoxycarbonxyl)-(S,S)norpseudoephedrine tms
Comments Computed using HOSE algorithm
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Exact Mass 405.269920652 u
Formula C23H39NO3Si
InChI InChI=1S/C23H39NO3Si/c1-16(2)20-14-13-17(3)15-21(20)26-23(25)24-18(4)22(27-28(5,6)7)19-11-9-8-10-12-19/h8-12,16-18,20-22H,13-15H2,1-7H3,(H,24,25)/t17-,18+,20+,21-,22-/m1/s1
InChIKey UVEFPEZWBTUNNH-OCFWJZSCSA-N
Molecular Weight 405.654 g/mol
SMILES [C@]([C@@](NC(O[C@]1([C@](C(C)C)(CC[C@](C1)(C)[H])[H])[H])=O)(C)[H])(C=1C=CC=CC1)(O[Si](C)(C)C)[H]