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18-[3-[1-(4-ANISIDYL)-1H-1,2,3-TRIAZOL-4-YL]-PROPANOYLOXY]-8,11,13-ABIETATRIENE
SpectraBase Compound ID Ds5whdGarbg
InChI InChI=1S/C32H41N3O3/c1-22(2)23-7-14-28-24(19-23)8-15-29-31(3,17-6-18-32(28,29)4)21-38-30(36)16-9-25-20-35(34-33-25)26-10-12-27(37-5)13-11-26/h7,10-14,19-20,22,29H,6,8-9,15-18,21H2,1-5H3/t29-,31-,32+/m0/s1
InChIKey QVMLFCJEMUDSTG-RUHGTMQNSA-N
Mol Weight 515.7 g/mol
Molecular Formula C32H41N3O3
Exact Mass 515.314792 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AicsvSQSnXV
Name 18-[3-[1-(4-ANISIDYL)-1H-1,2,3-TRIAZOL-4-YL]-PROPANOYLOXY]-8,11,13-ABIETATRIENE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H41N3O3
InChI InChI=1S/C32H41N3O3/c1-22(2)23-7-14-28-24(19-23)8-15-29-31(3,17-6-18-32(28,29)4)21-38-30(36)16-9-25-20-35(34-33-25)26-10-12-27(37-5)13-11-26/h7,10-14,19-20,22,29H,6,8-9,15-18,21H2,1-5H3/t29-,31-,32+/m0/s1
InChIKey QVMLFCJEMUDSTG-RUHGTMQNSA-N
Literature Reference Author M.W.PERTINO,V.VERDUGO,C.THEODULOZ,G.SCHMEDA-HIRSCHMANN
Literature Reference Citation MOLECULES,19,2523(2014)
Literature Reference DOI 10.3390/molecules19022523
Molecular Weight 515.696 g/mol
Solvent CDCl3
Source File Reference UWBT14369