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N-BENZYL-[(ANTI)-(ANTI)-3-ACETOXY-2-TERT.-BUTOXYCARBONYLAMINO-CYCLOHEXANE-1-CARBOXYL]-AMIDE
SpectraBase Compound ID 6PQbYF3MmYf
InChI InChI=1S/C21H30N2O5/c1-14(24)27-17-12-8-11-16(18(17)23-20(26)28-21(2,3)4)19(25)22-13-15-9-6-5-7-10-15/h5-7,9-10,16-18H,8,11-13H2,1-4H3,(H,22,25)(H,23,26)/t16-,17+,18+/m1/s1
InChIKey BQTOVWVLEFIJNL-SQNIBIBYSA-N
Mol Weight 390.48 g/mol
Molecular Formula C21H30N2O5
Exact Mass 390.215472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ahte960Fbc
Name N-BENZYL-[(ANTI)-(ANTI)-3-ACETOXY-2-TERT.-BUTOXYCARBONYLAMINO-CYCLOHEXANE-1-CARBOXYL]-AMIDE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30N2O5
InChI InChI=1S/C21H30N2O5/c1-14(24)27-17-12-8-11-16(18(17)23-20(26)28-21(2,3)4)19(25)22-13-15-9-6-5-7-10-15/h5-7,9-10,16-18H,8,11-13H2,1-4H3,(H,22,25)(H,23,26)/t16-,17+,18+/m1/s1
InChIKey BQTOVWVLEFIJNL-SQNIBIBYSA-N
Literature Reference Author I.B.MASESANE,A.S.BATSANOV,J.A.K.HOWARD,R.MONDAL,P.G.STEEL
Literature Reference Citation BEIL.J.ORG.CHEM.,2,9,1(2006)
Literature Reference DOI 10.1186/1860-5397-2-9
Molecular Weight 390.480 g/mol
Solvent CD3OD
Source File Reference UWBT10911