For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
12-O-(3-(((1-PHENYLTHIO)-METHYL)-1H-1,2,3-TRIAZOL-4-YL)-PROPANOYLOXY)-11,20-EPOXYABIETA-8,11,13-TRIEN-20-ONE
SpectraBase Compound ID 95d74RHrwEo
InChI InChI=1S/C32H37N3O4S/c1-20(2)24-17-21-11-13-25-31(3,4)15-8-16-32(25)27(21)29(39-30(32)37)28(24)38-26(36)14-12-22-18-35(34-33-22)19-40-23-9-6-5-7-10-23/h5-7,9-10,17-18,20,25H,8,11-16,19H2,1-4H3/t25-,32+/m0/s1
InChIKey RCEASNDKWAVDTK-ZOYWYXQUSA-N
Mol Weight 559.7 g/mol
Molecular Formula C32H37N3O4S
Exact Mass 559.250478 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FbZwoi9L9Oy
Name 12-O-(3-(((1-PHENYLTHIO)-METHYL)-1H-1,2,3-TRIAZOL-4-YL)-PROPANOYLOXY)-11,20-EPOXYABIETA-8,11,13-TRIEN-20-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H37N3O4S
InChI InChI=1S/C32H37N3O4S/c1-20(2)24-17-21-11-13-25-31(3,4)15-8-16-32(25)27(21)29(39-30(32)37)28(24)38-26(36)14-12-22-18-35(34-33-22)19-40-23-9-6-5-7-10-23/h5-7,9-10,17-18,20,25H,8,11-16,19H2,1-4H3/t25-,32+/m0/s1
InChIKey RCEASNDKWAVDTK-ZOYWYXQUSA-N
Literature Reference Author M.W.PERTINO,C.THEODULOZ,E.BUTASSI,S.ZACCHINO,G.SCHMEDA-HIRSC HMANN
Literature Reference Citation MOLECULES,20,8666(2015)
Literature Reference DOI 10.3390/molecules20058666
Molecular Weight 559.723 g/mol
Solvent CDCl3
Source File Reference UWPA3140