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3,4-SECO-FRIEDELAN-3-OIC-ACID

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3,4-SECO-FRIEDELAN-3-OIC-ACID
SpectraBase Compound ID FEnV63XaKDy
InChI InChI=1S/C30H52O2/c1-9-26(4)13-12-22-28(6,21(26)10-11-24(31)32)17-19-30(8)23-20-25(2,3)14-15-27(23,5)16-18-29(22,30)7/h21-23H,9-20H2,1-8H3,(H,31,32)/t21-,22+,23-,26+,27-,28+,29-,30+/m1/s1
InChIKey BFSGNXOBYJTARW-RKIYCPPPSA-N
Mol Weight 444.7 g/mol
Molecular Formula C30H52O2
Exact Mass 444.396731 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K9Ct9wkR2ia
Name 3,4-SECO-FRIEDELAN-3-OIC-ACID
Compound Number 2
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H52O2
InChI InChI=1S/C30H52O2/c1-9-26(4)13-12-22-28(6,21(26)10-11-24(31)32)17-19-30(8)23-20-25(2,3)14-15-27(23,5)16-18-29(22,30)7/h21-23H,9-20H2,1-8H3,(H,31,32)/t21-,22+,23-,26+,27-,28+,29-,30+/m1/s1
InChIKey BFSGNXOBYJTARW-RKIYCPPPSA-N
Literature Reference Author S.A.VIEIRAFILHO,L.P.DUARTE,G.D.F.SILVA,I.S.LULA,M.H.DOSSANTO S
Literature Reference Citation MAGN.RES.CHEM.,39,746(2001)
Literature Reference DOI 10.1002/mrc.942
Molecular Weight 444.742 g/mol
Solvent CDCl3
Source File Reference UWKP6381