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(+/-)-ROSEMARINIC-ACID-BENZYLESTER
SpectraBase Compound ID L9JzGrnTXMy
InChI InChI=1S/C25H22O8/c26-19-9-6-16(12-21(19)28)8-11-24(30)33-23(14-18-7-10-20(27)22(29)13-18)25(31)32-15-17-4-2-1-3-5-17/h1-13,23,26-29H,14-15H2/b11-8+
InChIKey NRZZGGCSMHSHME-DHZHZOJOSA-N
Mol Weight 450.44 g/mol
Molecular Formula C25H22O8
Exact Mass 450.131468 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 171H8qFdAcT
Name (+/-)-ROSEMARINIC-ACID-BENZYLESTER
Compound Number 10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H22O8
InChI InChI=1S/C25H22O8/c26-19-9-6-16(12-21(19)28)8-11-24(30)33-23(14-18-7-10-20(27)22(29)13-18)25(31)32-15-17-4-2-1-3-5-17/h1-13,23,26-29H,14-15H2/b11-8+
InChIKey NRZZGGCSMHSHME-DHZHZOJOSA-N
Literature Reference Author E.REIMANN,H.J.MAAS,T.PFLUG
Literature Reference Citation MH.CHEM.,128,995(1997)
Literature Reference DOI 10.1007/BF00806966
Molecular Weight 450.445 g/mol
Solvent CD3OD
Source File Reference UWRK2834