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METHYL-CHLOROGENATE

View entire compound with spectra: 3 NMR

METHYL-CHLOROGENATE
SpectraBase Compound ID C9p7tmXzs7B
InChI InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1
InChIKey MZNIJRAPCCELQX-AWOKGZDASA-N
Mol Weight 368.34 g/mol
Molecular Formula C17H20O9
Exact Mass 368.110732 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1lr4p2F2yzL
Name CHLOROGENIC-ACID-METHYLESTER
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20O9
InChI InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1
InChIKey MZNIJRAPCCELQX-AWOKGZDASA-N
Literature Reference Author M.ZHANG,W.X.LIU,M.F.ZHENG,Q.L.XU,F.H.WAN,J.WANG,T.LEI,Z.Y.ZH OU,J.W.TAN
Literature Reference Citation MOLECULES,18,14096(2013)
Literature Reference DOI 10.3390/molecules181114096
Molecular Weight 368.340 g/mol
Solvent CD3OD
Source File Reference UWIR9899