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Methyl-siaresinolate
SpectraBase Compound ID 9IZgcjHElZN
InChI InChI=1S/C31H50O4/c1-26(2)15-17-31(25(34)35-8)18-16-29(6)19(23(31)24(26)33)9-10-21-28(5)13-12-22(32)27(3,4)20(28)11-14-30(21,29)7/h9,20-24,32-33H,10-18H2,1-8H3/t20?,21-,22?,23+,24+,28?,29-,30+,31-/m1/s1
InChIKey UGARKTHCZFANNF-SITOIMKUSA-N
Mol Weight 486.7 g/mol
Molecular Formula C31H50O4
Exact Mass 486.37091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FlLj5SSiHyj
Name Methyl-siaresinolate
Comments broad-band decoupling (BB)
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Formula C31H50O4
InChI InChI=1S/C31H50O4/c1-26(2)15-17-31(25(34)35-8)18-16-29(6)19(23(31)24(26)33)9-10-21-28(5)13-12-22(32)27(3,4)20(28)11-14-30(21,29)7/h9,20-24,32-33H,10-18H2,1-8H3/t20?,21-,22?,23+,24+,28?,29-,30+,31-/m1/s1
InChIKey UGARKTHCZFANNF-SITOIMKUSA-N
Instrument Name SF = 400 MHz
Literature Reference Chem. Pharm. Bull. 35, 841 (1987).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Pyridine-D5