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1-AMINO-N,O-DIBENZOYL-TRIDEC-5-EN-2-OL

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1-AMINO-N,O-DIBENZOYL-TRIDEC-5-EN-2-OL
SpectraBase Compound ID FNMDmHr0Uzw
InChI InChI=1S/C27H35NO3/c1-2-3-4-5-6-7-8-9-16-21-25(31-27(30)24-19-14-11-15-20-24)22-28-26(29)23-17-12-10-13-18-23/h8-15,17-20,25H,2-7,16,21-22H2,1H3,(H,28,29)/b9-8+/t25-/m1/s1
InChIKey OEJWAAZEOSFPJQ-REJWQLKLSA-N
Mol Weight 421.6 g/mol
Molecular Formula C27H35NO3
Exact Mass 421.261694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2NvFnfwlSB5
Name 1-AMINO-N,O-DIBENZOYL-TRIDEC-5-EN-2-OL
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H35NO3
InChI InChI=1S/C27H35NO3/c1-2-3-4-5-6-7-8-9-16-21-25(31-27(30)24-19-14-11-15-20-24)22-28-26(29)23-17-12-10-13-18-23/h8-15,17-20,25H,2-7,16,21-22H2,1H3,(H,28,29)/b9-8+/t25-/m1/s1
InChIKey OEJWAAZEOSFPJQ-REJWQLKLSA-N
Literature Reference Author P.A.SEARLE,T.F.MOLINSKI
Literature Reference Citation J.ORG.CHEM.,58,7578(1993)
Literature Reference DOI 10.1021/jo00078a045
Molecular Weight 421.580 g/mol
Solvent CDCl3
Source File Reference UWMZ1673