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(5S)-Methyl .delta-butyryloxy-.delta.-(p-methoxyphenyl)-.beta.-oxo-pentanoate
SpectraBase Compound ID E53PZzGU0gJ
InChI InChI=1S/C17H22O6/c1-4-5-16(19)23-15(10-13(18)11-17(20)22-3)12-6-8-14(21-2)9-7-12/h6-9,15H,4-5,10-11H2,1-3H3/t15-/m0/s1
InChIKey XDNLGZJUPYVTBK-HNNXBMFYSA-N
Mol Weight 322.36 g/mol
Molecular Formula C17H22O6
Exact Mass 322.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9bO4GKYW706
Name (5S)-Methyl .delta-butyryloxy-.delta.-(p-methoxyphenyl)-.beta.-oxo-pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O6
InChI InChI=1S/C17H22O6/c1-4-5-16(19)23-15(10-13(18)11-17(20)22-3)12-6-8-14(21-2)9-7-12/h6-9,15H,4-5,10-11H2,1-3H3/t15-/m0/s1
InChIKey XDNLGZJUPYVTBK-HNNXBMFYSA-N
Molecular Weight 322.357 g/mol
SMILES [C@](CC(CC(=O)OC)=O)(OC(=O)CCC)(c1ccc(cc1)OC)[H]
SPLASH splash10-000i-1920000000-1e6d91fe904c083dda63
Source of Spectrum KC-61-2179-8
Wiley ID 1628019