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6-ACETOXY-5-[[5-(2-AMINO-1,3,4-OXADIAZOL-5-YL)-1,2,3-TRIAZOL-1-YL]-METHYL]-2,7,8-TRIMETHYL-2-(4,8,12-TRIMETHYLTRIDECYL)-CHROMAN

View entire compound with spectra: 1 NMR

6-ACETOXY-5-[[5-(2-AMINO-1,3,4-OXADIAZOL-5-YL)-1,2,3-TRIAZOL-1-YL]-METHYL]-2,7,8-TRIMETHYL-2-(4,8,12-TRIMETHYLTRIDECYL)-CHROMAN
SpectraBase Compound ID AQSwtwVPSaf
InChI InChI=1S/C35H54N6O4/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-18-35(8)19-17-28-29(31(43-27(7)42)25(5)26(6)32(28)45-35)21-41-30(20-37-40-41)33-38-39-34(36)44-33/h20,22-24H,9-19,21H2,1-8H3,(H2,36,39)
InChIKey JBWJYYYWCYDOSB-UHFFFAOYSA-N
Mol Weight 622.9 g/mol
Molecular Formula C35H54N6O4
Exact Mass 622.420654 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EwnhYtFSTaY
Name 6-ACETOXY-5-[[5-(2-AMINO-1,3,4-OXADIAZOL-5-YL)-1,2,3-TRIAZOL-1-YL]-METHYL]-2,7,8-TRIMETHYL-2-(4,8,12-TRIMETHYLTRIDECYL)-CHROMAN
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H54N6O4
InChI InChI=1S/C35H54N6O4/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-18-35(8)19-17-28-29(31(43-27(7)42)25(5)26(6)32(28)45-35)21-41-30(20-37-40-41)33-38-39-34(36)44-33/h20,22-24H,9-19,21H2,1-8H3,(H2,36,39)
InChIKey JBWJYYYWCYDOSB-UHFFFAOYSA-N
Literature Reference Author C.ADELWOEHRER,T.ROSENAU,E.KLOSER,K.MEREITER,T.NETSCHER
Literature Reference Citation EUR.J.ORG.CHEM.,2081(2006)
Literature Reference DOI 10.1002/ejoc.200500898
Molecular Weight 622.852 g/mol
Sample ID 33522
Solvent CDCl3