SpectraBase Compound ID | 1j98NX4I5nL |
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InChI | InChI=1S/C37H42O5/c1-24(2)26-15-18-29-28(17-20-33-36(29,3)21-10-22-37(33,4)35(40)41-5)27(26)16-19-31(39)34-30(38)13-9-14-32(34)42-23-25-11-7-6-8-12-25/h6-9,11-16,18-19,24,33,38H,10,17,20-23H2,1-5H3/b19-16+/t33-,36-,37-/m1/s1 |
InChIKey | DLYROCWIBZMLBX-JJRJMBFQSA-N |
Mol Weight | 566.7 g/mol |
Molecular Formula | C37H42O5 |
Exact Mass | 566.303224 g/mol |
SpectraBase Spectrum ID | BqtL4I9nAm8 |
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Name | METHYL-14-[2-(6-BENZYLOXY-2-HYDROXYBENZOYL)-VINYL]-DEHYDROABIETATE |
Compound Number | 6C |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C37H42O5 |
InChI | InChI=1S/C37H42O5/c1-24(2)26-15-18-29-28(17-20-33-36(29,3)21-10-22-37(33,4)35(40)41-5)27(26)16-19-31(39)34-30(38)13-9-14-32(34)42-23-25-11-7-6-8-12-25/h6-9,11-16,18-19,24,33,38H,10,17,20-23H2,1-5H3/b19-16+/t33-,36-,37-/m1/s1 |
InChIKey | DLYROCWIBZMLBX-JJRJMBFQSA-N |
Literature Reference Author | S.M.C.S.MONTEIRO,A.J.D.SILVESTRE,A.M.S.SILVA,J.A.S.CAVALEIRO |
Literature Reference Citation | MH.CHEM.,139,1119(2008) |
Literature Reference DOI | 10.1007/s00706-008-0889-1 |
Molecular Weight | 566.737 g/mol |
Sample ID | 40073 |
Solvent | CDCl3 |