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(E)-3-METHYL-5-[(1R,4A-S,5R,8A-S)-4A,5,8A-TRIMETHYL-2-METHYLENE-DECAHYDRO-1-NAPHTHALENYL]-PENT-2-ENOIC-ACID-METHYLESTER
SpectraBase Compound ID 4KL4rYjeQXL
InChI InChI=1S/C21H34O2/c1-15(14-19(22)23-6)9-10-18-16(2)11-13-20(4)17(3)8-7-12-21(18,20)5/h14,17-18H,2,7-13H2,1,3-6H3/b15-14+/t17-,18-,20+,21+/m1/s1
InChIKey RVKNMWXALYHJGR-SUBHDGCFSA-N
Mol Weight 318.5 g/mol
Molecular Formula C21H34O2
Exact Mass 318.25588 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ee1tA5lPyB9
Name (E)-3-METHYL-5-[(1R,4A-S,5R,8A-S)-4A,5,8A-TRIMETHYL-2-METHYLENE-DECAHYDRO-1-NAPHTHALENYL]-PENT-2-ENOIC-ACID-METHYLESTER
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H34O2
InChI InChI=1S/C21H34O2/c1-15(14-19(22)23-6)9-10-18-16(2)11-13-20(4)17(3)8-7-12-21(18,20)5/h14,17-18H,2,7-13H2,1,3-6H3/b15-14+/t17-,18-,20+,21+/m1/s1
InChIKey RVKNMWXALYHJGR-SUBHDGCFSA-N
Literature Reference Author S.DIAZ,J.CUESTA,A.GONZALES,J.BONJOCH
Literature Reference Citation J.ORG.CHEM.,68,7400(2003)
Literature Reference DOI 10.1021/jo034838r
Molecular Weight 318.500 g/mol
Solvent Unknown
Source File Reference UWMS26399