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2-DEOXY-ECDYSONE

View entire compound with spectra: 1 NMR

2-DEOXY-ECDYSONE
SpectraBase Compound ID JtQjO43Vxg9
InChI InChI=1S/C27H44O5/c1-16(22(29)9-10-24(2,3)31)18-8-13-27(32)20-15-23(30)21-14-17(28)6-11-25(21,4)19(20)7-12-26(18,27)5/h15-19,21-22,28-29,31-32H,6-14H2,1-5H3/t16-,17-,18+,19-,21-,22+,25+,26+,27+/m0/s1
InChIKey CRAPXAGGASWTPU-VQOIUDCISA-N
Mol Weight 448.6 g/mol
Molecular Formula C27H44O5
Exact Mass 448.318875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LjivnG64PMl
Name 2-DEOXY-ECDYSONE
Compound Number 2DE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H44O5
InChI InChI=1S/C27H44O5/c1-16(22(29)9-10-24(2,3)31)18-8-13-27(32)20-15-23(30)21-14-17(28)6-11-25(21,4)19(20)7-12-26(18,27)5/h15-19,21-22,28-29,31-32H,6-14H2,1-5H3/t16-,17-,18+,19-,21-,22+,25+,26+,27+/m0/s1
InChIKey CRAPXAGGASWTPU-VQOIUDCISA-N
Literature Reference Author R.HO,J.P.GIRAULT,P.Y.COUSTEAU,J.P.BIANCHINI,P.RAHARIVELOMANA NA,R.LAFONT
Literature Reference Citation J.CHROMAT.SCI.,46,102(2008)
Literature Reference DOI 10.1093/chromsci/46.2.102
Molecular Weight 448.643 g/mol
Solvent CD3OD
Source File Reference UWLU76375