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(4S,5S)-5-hexyl-4-methyl-2-oxolanone
SpectraBase Compound ID 2PoX2smU3e1
InChI InChI=1S/C11H20O2/c1-3-4-5-6-7-10-9(2)8-11(12)13-10/h9-10H,3-8H2,1-2H3/t9-,10-/m0/s1
InChIKey XNRLAEXLQFIKEY-UWVGGRQHSA-N
Mol Weight 184.28 g/mol
Molecular Formula C11H20O2
Exact Mass 184.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EB9t5aBOZmS
Name (4S,5S)-5-hexyl-4-methyl-2-oxolanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O2
InChI InChI=1S/C11H20O2/c1-3-4-5-6-7-10-9(2)8-11(12)13-10/h9-10H,3-8H2,1-2H3/t9-,10-/m0/s1
InChIKey XNRLAEXLQFIKEY-UWVGGRQHSA-N
Molecular Weight 184.279 g/mol
SMILES C1(O[C@]([C@](C1)(C)[H])(CCCCCC)[H])=O
SPLASH splash10-0002-9200000000-97915792bf3a2531936c
Source of Spectrum J-67-3808-1
Synonyms (4S,5S)-5-hexyl-4-methyl-oxolan-2-one (4S,5S)-5-hexyl-4-methyl-tetrahydrofuran-2-one
Wiley ID 1569979