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(2R*,4R*,5E,7S)-2-Acetoxy-7-isopropyl-4-methyl-10-oxo-5-undecen-4-olide
SpectraBase Compound ID 41LKler3C44
InChI InChI=1S/C17H26O5/c1-11(2)14(7-6-12(3)18)8-9-17(5)10-15(16(20)22-17)21-13(4)19/h8-9,11,14-15H,6-7,10H2,1-5H3/b9-8+/t14-,15-,17+/m1/s1
InChIKey MVDGPWYQGZRPRK-LXTSDDRQSA-N
Mol Weight 310.39 g/mol
Molecular Formula C17H26O5
Exact Mass 310.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID i8dvVrfewC
Name (2R*,4R*,5E,7S)-2-Acetoxy-7-isopropyl-4-methyl-10-oxo-5-undecen-4-olide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O5
InChI InChI=1S/C17H26O5/c1-11(2)14(7-6-12(3)18)8-9-17(5)10-15(16(20)22-17)21-13(4)19/h8-9,11,14-15H,6-7,10H2,1-5H3/b9-8+/t14-,15-,17+/m1/s1
InChIKey MVDGPWYQGZRPRK-LXTSDDRQSA-N
Molecular Weight 310.390 g/mol
SMILES C1(O[C@](\C=C\[C@@](CCC(=O)C)(C(C)C)[H])(C)C[C@]1(OC(=O)C)[H])=O
SPLASH splash10-0006-9200000000-8d9acb1cd92cd4d1a7d0
Source of Spectrum SB-48-856-15
Synonyms (3R,5R)-5-methyl-2-oxo-5-[(1E,3S)-6-oxo-3-(propan-2-yl)hept-1-en-1-yl]oxolan-3-yl acetate
Wiley ID 1311519