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TUBEROSIC-METHYLESTER
SpectraBase Compound ID KXtjajtURtL
InChI InChI=1S/C31H50O2/c1-20(26(32)33-8)21-12-17-28(4)22(21)13-18-30(6)24(28)10-11-25-29(5)16-9-15-27(2,3)23(29)14-19-31(25,30)7/h21-25H,1,9-19H2,2-8H3/t21-,22+,23+,24-,25-,28+,29+,30-,31-/m1/s1
InChIKey YEQPIOWVQRHGJC-ZTDMLWCVSA-N
Mol Weight 454.7 g/mol
Molecular Formula C31H50O2
Exact Mass 454.381081 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G9cxIRtT3Uw
Name TUBEROSIC-METHYLESTER
Compound Number 361
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H50O2
InChI InChI=1S/C31H50O2/c1-20(26(32)33-8)21-12-17-28(4)22(21)13-18-30(6)24(28)10-11-25-29(5)16-9-15-27(2,3)23(29)14-19-31(25,30)7/h21-25H,1,9-19H2,2-8H3/t21-,22+,23+,24-,25-,28+,29+,30-,31-/m1/s1
InChIKey YEQPIOWVQRHGJC-ZTDMLWCVSA-N
Literature Reference Author S.B.MAHATO,A.P.KUNDU
Literature Reference Citation PHYTOCHEM.,37,1517(1994)
Literature Reference DOI 10.1016/S0031-9422(00)89569-2
Molecular Weight 454.737 g/mol
Solvent CDCl3
Source File Reference UWMS5461