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ETHYL-5-[[(2E,4Z)-5-(2-ALLYLCYCLOPENTYL)-PENTA-2,4-DIENOYL]-AMINO]-PENTANOATE
SpectraBase Compound ID 96xmPJTJLov
InChI InChI=1S/C20H31NO3/c1-3-10-17-12-9-13-18(17)11-5-6-14-19(22)21-16-8-7-15-20(23)24-4-2/h3,5-6,11,14,17-18H,1,4,7-10,12-13,15-16H2,2H3,(H,21,22)/b11-5-,14-6+/t17-,18+/m1/s1
InChIKey JMXQSJKDVSURKF-LBQKKIMNSA-N
Mol Weight 333.47 g/mol
Molecular Formula C20H31NO3
Exact Mass 333.230394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1mTwZS69PeI
Name ETHYL-5-[[(2E,4Z)-5-(2-ALLYLCYCLOPENTYL)-PENTA-2,4-DIENOYL]-AMINO]-PENTANOATE
Compound Number 11E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H31NO3
InChI InChI=1S/C20H31NO3/c1-3-10-17-12-9-13-18(17)11-5-6-14-19(22)21-16-8-7-15-20(23)24-4-2/h3,5-6,11,14,17-18H,1,4,7-10,12-13,15-16H2,2H3,(H,21,22)/b11-5-,14-6+/t17-,18+/m1/s1
InChIKey JMXQSJKDVSURKF-LBQKKIMNSA-N
Literature Reference Author S.PACHALI,C.HOFMANN,G.RAPP,R.SCHOBERT,A.BARO,W.FREY,S.LASCHA T
Literature Reference Citation EUR.J.ORG.CHEM.,2009,2828(2009)
Literature Reference DOI 10.1002/ejoc.200900176
Molecular Weight 333.471 g/mol
Solvent CDCl3
Source File Reference UWIR20644