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ISOMER-#1
SpectraBase Compound ID I2Qpkuw0GjA
InChI InChI=1S/C31H52O2/c1-20(2)8-7-9-21(3)24-12-13-25-23-11-10-22-18-31(19-27(32)28(31)33-6)17-16-29(22,4)26(23)14-15-30(24,25)5/h20-26,28H,7-19H2,1-6H3/t21-,22+,23+,24-,25+,26+,28?,29+,30-,31-/m1/s1
InChIKey BDSLWVNVMSMEIV-JWXWWSHWSA-N
Mol Weight 456.8 g/mol
Molecular Formula C31H52O2
Exact Mass 456.396731 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G58Gpyk5lwd
Name ISOMER-#2
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H52O2
InChI InChI=1S/C31H52O2/c1-20(2)8-7-9-21(3)24-12-13-25-23-11-10-22-18-31(19-27(32)28(31)33-6)17-16-29(22,4)26(23)14-15-30(24,25)5/h20-26,28H,7-19H2,1-6H3/t21-,22+,23+,24-,25+,26+,28?,29+,30-,31-/m1/s1
InChIKey BDSLWVNVMSMEIV-JWXWWSHWSA-N
Literature Reference Author K.BLASZCZYK,Z.PARYZEK
Literature Reference Citation MAGN.RES.CHEM.,34,840(1996)
Literature Reference DOI 10.1002/(sici)1097-458x(199610)34:10<840::aid-omr1908>3.3.co;2-b
Molecular Weight 456.753 g/mol
Solvent CDCl3
Source File Reference UWCP2058