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BDMLELCPQIYMDP-MBEPAOCMSA-N

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BDMLELCPQIYMDP-MBEPAOCMSA-N
SpectraBase Compound ID BxwDW1g2r7T
InChI InChI=1S/C27H45NO3/c1-5-19-16-28(12-13-31-19)24-15-27(4)18(14-25(24)30)6-7-20-22-9-8-21(17(2)29)26(22,3)11-10-23(20)27/h18-25,30H,5-16H2,1-4H3/t18?,19-,20?,21+,22?,23?,24+,25+,26+,27-/m0/s1
InChIKey BDMLELCPQIYMDP-MBEPAOCMSA-N
Mol Weight 431.7 g/mol
Molecular Formula C27H45NO3
Exact Mass 431.339944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 42K0C6rTdII
Name BDMLELCPQIYMDP-MBEPAOCMSA-N
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H45NO3
InChI InChI=1S/C27H45NO3/c1-5-19-16-28(12-13-31-19)24-15-27(4)18(14-25(24)30)6-7-20-22-9-8-21(17(2)29)26(22,3)11-10-23(20)27/h18-25,30H,5-16H2,1-4H3/t18?,19-,20?,21+,22?,23?,24+,25+,26+,27-/m0/s1
InChIKey BDMLELCPQIYMDP-MBEPAOCMSA-N
Literature Reference Author L.FIELDING,N.HAMILTON,R.MCGUIRE,M.MAIDMENT,A.C.CAMPBELL
Literature Reference Citation MAGN.RES.CHEM.,34,59(1996)
Literature Reference DOI 10.1002/(sici)1097-458x(199601)34:1<59::aid-omr830>3.0.co;2-7
Molecular Weight 431.659 g/mol
Solvent CDCl3
Source File Reference UWCP2329