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2-BENZYL-3-OXO-BUTYRIC-ACID-2'-METHOXYCARBONYL-ALLYLESTER
SpectraBase Compound ID 6qY6Ez14guv
InChI InChI=1S/C16H18O5/c1-11(15(18)20-3)10-21-16(19)14(12(2)17)9-13-7-5-4-6-8-13/h4-8,14H,1,9-10H2,2-3H3
InChIKey CBNQAEMXUKUUST-UHFFFAOYSA-N
Mol Weight 290.31 g/mol
Molecular Formula C16H18O5
Exact Mass 290.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ANHdkiPBJJK
Name 2-BENZYL-3-OXO-BUTYRIC-ACID-2'-METHOXYCARBONYL-ALLYLESTER
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18O5
InChI InChI=1S/C16H18O5/c1-11(15(18)20-3)10-21-16(19)14(12(2)17)9-13-7-5-4-6-8-13/h4-8,14H,1,9-10H2,2-3H3
InChIKey CBNQAEMXUKUUST-UHFFFAOYSA-N
Literature Reference Author V.BIZET,V.LEFEBVRE,J.BAUDOUX,M.C.LASNE,A.BOULANGE,S.LELEU,X. FRANCK,J.ROUDEN
Literature Reference Citation EUR.J.ORG.CHEM.,2011,4170(2011)
Literature Reference DOI 10.1002/ejoc.201100120
Molecular Weight 290.316 g/mol
Solvent CDCl3
Source File Reference UWBT20703