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METHYL-4-OXO-4,5-SECO-CARYPHYLLEN-5-OATE

View entire compound with spectra: 1 NMR

METHYL-4-OXO-4,5-SECO-CARYPHYLLEN-5-OATE
SpectraBase Compound ID JXNBVI8toJD
InChI InChI=1S/C16H26O3/c1-11(6-9-15(18)19-5)13-10-16(3,4)14(13)8-7-12(2)17/h13-14H,1,6-10H2,2-5H3/t13-,14-/m1/s1
InChIKey YYOBSKGBCIIJSK-ZIAGYGMSSA-N
Mol Weight 266.38 g/mol
Molecular Formula C16H26O3
Exact Mass 266.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4uRhFFckeEj
Name METHYL-4-OXO-4,5-SECO-CARYPHYLLEN-5-OATE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H26O3
InChI InChI=1S/C16H26O3/c1-11(6-9-15(18)19-5)13-10-16(3,4)14(13)8-7-12(2)17/h13-14H,1,6-10H2,2-5H3/t13-,14-/m1/s1
InChIKey YYOBSKGBCIIJSK-ZIAGYGMSSA-N
Literature Reference Author L.QUIJANO,A.VASQUEZ,T.RIOS
Literature Reference Citation PHYTOCHEM.,38,1251(1995)
Literature Reference DOI 10.1016/0031-9422(94)00791-Q
Molecular Weight 266.381 g/mol
Solvent CDCl3
Source File Reference UWMS3952