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(2R,4S,5S,6S,7R)-6-Ethyl-2,4-dimethyl-7-(4-methoxybenzyloxy)nonan-5-olide
SpectraBase Compound ID ERY8f45z6fD
InChI InChI=1S/C21H32O4/c1-6-18(20-14(3)12-15(4)21(22)25-20)19(7-2)24-13-16-8-10-17(23-5)11-9-16/h8-11,14-15,18-20H,6-7,12-13H2,1-5H3/t14-,15+,18-,19+,20-/m0/s1
InChIKey XGJNQKHXXXUGIE-DJLVLGKWSA-N
Mol Weight 348.5 g/mol
Molecular Formula C21H32O4
Exact Mass 348.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2TJyCoOIH5x
Name (2R,4S,5S,6S,7R)-6-Ethyl-2,4-dimethyl-7-(4-methoxybenzyloxy)nonan-5-olide
Alternate Name(s) (3R,5S,6S)-6-{(1S,2R)-1-ethyl-2-[(4-methoxybenzyl)oxy]butyl}-3,5-dimethyltetrahydro-2H-pyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O4
InChI InChI=1S/C21H32O4/c1-6-18(20-14(3)12-15(4)21(22)25-20)19(7-2)24-13-16-8-10-17(23-5)11-9-16/h8-11,14-15,18-20H,6-7,12-13H2,1-5H3/t14-,15+,18-,19+,20-/m0/s1
InChIKey XGJNQKHXXXUGIE-DJLVLGKWSA-N
Molecular Weight 348.483 g/mol
SMILES [C@]1(OC([C@@](C[C@@]1(C)[H])(C)[H])=O)([C@]([C@](OCc1ccc(cc1)OC)(CC)[H])(CC)[H])[H]
SPLASH splash10-00di-0900000000-8408b92c3b7282d7886d
Source of Spectrum E1-37-1703-25
Wiley ID 1517781