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15-[4-(HYDROXYMETHYL)-1H-1,2,3-TRIAZOL-1-YL]-IMBRICATOLIC-ACID-METHYLESTER
SpectraBase Compound ID HrboX8EUxR8
InChI InChI=1S/C24H39N3O3/c1-17(11-14-27-15-19(16-28)25-26-27)7-9-20-18(2)8-10-21-23(20,3)12-6-13-24(21,4)22(29)30-5/h15,17,20-21,28H,2,6-14,16H2,1,3-5H3/t17-,20+,21-,23-,24+/m1/s1
InChIKey NTRGCJRVXYYSIL-PSDCOACLSA-N
Mol Weight 417.6 g/mol
Molecular Formula C24H39N3O3
Exact Mass 417.299142 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7pXt8WcQB7d
Name 15-[4-(HYDROXYMETHYL)-1H-1,2,3-TRIAZOL-1-YL]-IMBRICATOLIC-ACID-METHYLESTER
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H39N3O3
InChI InChI=1S/C24H39N3O3/c1-17(11-14-27-15-19(16-28)25-26-27)7-9-20-18(2)8-10-21-23(20,3)12-6-13-24(21,4)22(29)30-5/h15,17,20-21,28H,2,6-14,16H2,1,3-5H3/t17-,20+,21-,23-,24+/m1/s1
InChIKey NTRGCJRVXYYSIL-PSDCOACLSA-N
Literature Reference Author M.W.PERTINO,C.THEODULOZ,M.BASTIAS,G.SCHMEDA-HIRSCHMANN
Literature Reference Citation MOLECULES,18,5936(2013)
Literature Reference DOI 10.3390/molecules18055936
Molecular Weight 417.592 g/mol
Solvent CDCl3
Source File Reference UWBT9390