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METHYL-(E)-4-[2-(3,4-DIHYDRO-4,4-DIMETHYL-2H-1-BENZOPYRAN-6-YL)-3-HYDROXY-1-PROPENYL]-BENZOATE
SpectraBase Compound ID 4XauksgxXt7
InChI InChI=1S/C22H24O4/c1-22(2)10-11-26-20-9-8-17(13-19(20)22)18(14-23)12-15-4-6-16(7-5-15)21(24)25-3/h4-9,12-13,23H,10-11,14H2,1-3H3/b18-12+
InChIKey YASHCXFTSSTBLL-LDADJPATSA-N
Mol Weight 352.43 g/mol
Molecular Formula C22H24O4
Exact Mass 352.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8r6aCD2JHlL
Name METHYL-(E)-4-[2-(3,4-DIHYDRO-4,4-DIMETHYL-2H-1-BENZOPYRAN-6-YL)-3-HYDROXY-1-PROPENYL]-BENZOATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24O4
InChI InChI=1S/C22H24O4/c1-22(2)10-11-26-20-9-8-17(13-19(20)22)18(14-23)12-15-4-6-16(7-5-15)21(24)25-3/h4-9,12-13,23H,10-11,14H2,1-3H3/b18-12+
InChIKey YASHCXFTSSTBLL-LDADJPATSA-N
Literature Reference Author J.B.GALE,S.N.RAJADHYAKSHA,L.W.SPRUCE,K.D.BERLIN,X.JI,A.SLAGL E,D.VANDERHELM
Literature Reference Citation J.ORG.CHEM.,55,3984(1990)
Literature Reference DOI 10.1021/jo00300a009
Molecular Weight 352.430 g/mol
Solvent CDCl3
Source File Reference UWED12514