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Methyl (R*,R*-(E))-(+-)-5-Hydroxy-2,4-dimethyl-7-oxo-8-(phenylmethoxy)-2-octenoate
SpectraBase Compound ID 3SAEy5DeHY1
InChI InChI=1S/C18H24O5/c1-13(9-14(2)18(21)22-3)17(20)10-16(19)12-23-11-15-7-5-4-6-8-15/h4-9,13,17,20H,10-12H2,1-3H3/b14-9+/t13-,17-/m1/s1
InChIKey XNDGBUBMSGDFSL-XAMKJOQJSA-N
Mol Weight 320.38 g/mol
Molecular Formula C18H24O5
Exact Mass 320.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2K9CHTvBbR5
Name Methyl (R*,R*-(E))-(+-)-5-Hydroxy-2,4-dimethyl-7-oxo-8-(phenylmethoxy)-2-octenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O5
InChI InChI=1S/C18H24O5/c1-13(9-14(2)18(21)22-3)17(20)10-16(19)12-23-11-15-7-5-4-6-8-15/h4-9,13,17,20H,10-12H2,1-3H3/b14-9+/t13-,17-/m1/s1
InChIKey XNDGBUBMSGDFSL-XAMKJOQJSA-N
Molecular Weight 320.385 g/mol
SMILES O[C@](CC(=O)COCc1ccccc1)([C@@](\C=C\(C(=O)OC)C)(C)[H])[H]
SPLASH splash10-002f-9500000000-e26d0bd9a8b143119540
Source of Spectrum F-47-4140-14
Synonyms Methyl (2E,4R,5R)-8-(benzyloxy)-5-hydroxy-2,4-dimethyl-7-oxo-2-octenoate
Wiley ID 1320150