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Parguerol acetate
SpectraBase Compound ID 9L0W7N9YT8G
InChI InChI=1S/C28H39BrO8/c1-15(30)34-13-25(29)26(5)8-7-20-19(10-26)22(36-17(3)32)9-24-27(20,6)12-23(37-18(4)33)21-11-28(21,24)14-35-16(2)31/h7,19,21-25H,8-14H2,1-6H3
InChIKey WXOXKGLRHFVTBW-UHFFFAOYSA-N
Mol Weight 583.5 g/mol
Molecular Formula C28H39BrO8
Exact Mass 582.182831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CwzthEKOyos
Name Parguerol acetate
CAS Registry Number 83115-37-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H39BrO8
InChI InChI=1S/C28H39BrO8/c1-15(30)34-13-25(29)26(5)8-7-20-19(10-26)22(36-17(3)32)9-24-27(20,6)12-23(37-18(4)33)21-11-28(21,24)14-35-16(2)31/h7,19,21-25H,8-14H2,1-6H3
InChIKey WXOXKGLRHFVTBW-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference F.J. Schmitz, D.P. Michaud, P.G. Schmidt, J. Am. Chem. Soc. 104, 6415 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3