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3-Benzyloxy-5-(benzyloxy-methoxy)-4-methyl-hexanoic acid, methyl ester

View entire compound with spectra: 16 NMR

3-Benzyloxy-5-(benzyloxy-methoxy)-4-methyl-hexanoic acid, methyl ester
SpectraBase Compound ID 15d1dJLA1tK
InChI InChI=1S/C23H30O5/c1-18(19(2)28-17-26-15-20-10-6-4-7-11-20)22(14-23(24)25-3)27-16-21-12-8-5-9-13-21/h4-13,18-19,22H,14-17H2,1-3H3
InChIKey PODVWKXGOVMMCV-UHFFFAOYSA-N
Mol Weight 386.49 g/mol
Molecular Formula C23H30O5
Exact Mass 386.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DSL625IABnN
Name 3-Benzyloxy-5-(benzyloxy-methoxy)-4-methyl-hexanoic acid, methyl ester
CAS Registry Number 87518-92-1
Comments ISOMER 1 CHEMICAL SHIFTS ARE INTERCHANGEABLE BETWEEN ISOMERS
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H30O5
InChI InChI=1S/C23H30O5/c1-18(19(2)28-17-26-15-20-10-6-4-7-11-20)22(14-23(24)25-3)27-16-21-12-8-5-9-13-21/h4-13,18-19,22H,14-17H2,1-3H3
InChIKey PODVWKXGOVMMCV-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference S. Thaisrivongs, D. Seebach, J. Am. Chem. Soc. 105, 7407 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3