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MYRTUCOMMULONE-D
SpectraBase Compound ID HHwpQeopD6B
InChI InChI=1S/C38H50O9/c1-15(2)18-20-26(40)23(25(39)17(5)6)28-21(27(20)46-31-22(18)29(41)34(7,8)32(43)36(31,11)12)19(16(3)4)24-30(42)35(9,10)33(44)37(13,14)38(24,45)47-28/h15-19,24,40,45H,1-14H3/t18-,19-,24+,38-/m1/s1
InChIKey ITNDAFZKMDPQMX-HXASEXNCSA-N
Mol Weight 650.8 g/mol
Molecular Formula C38H50O9
Exact Mass 650.345483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9rZUaSkKF0S
Name MYRTUCOMMULONE-D
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H50O9
InChI InChI=1S/C38H50O9/c1-15(2)18-20-26(40)23(25(39)17(5)6)28-21(27(20)46-31-22(18)29(41)34(7,8)32(43)36(31,11)12)19(16(3)4)24-30(42)35(9,10)33(44)37(13,14)38(24,45)47-28/h15-19,24,40,45H,1-14H3/t18-,19-,24+,38-/m1/s1
InChIKey ITNDAFZKMDPQMX-HXASEXNCSA-N
Literature Reference Author F.SHAHEEN,M.AHMAD,S.N.KHAN,S.S.HUSSAIN,S.ANJUM,B.TASHKHODJAE V,K.TURGUNOV,M.N.SUL
Literature Reference Citation EUR.J.ORG.CHEM.,2371(2006)
Molecular Weight 650.810 g/mol
Sample ID 44887
Solvent CDCl3