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l-3-(Acetylsulfanyl)-4-methylhexyl Acetate
SpectraBase Compound ID D3ROD8OGn2y
InChI InChI=1S/C11H20O3S/c1-5-8(2)11(15-10(4)13)6-7-14-9(3)12/h8,11H,5-7H2,1-4H3/t8-,11-/m1/s1
InChIKey CLOGDESPGCFJPG-LDYMZIIASA-N
Mol Weight 232.34 g/mol
Molecular Formula C11H20O3S
Exact Mass 232.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ciuJfFiPpd
Name l-3-(Acetylsulfanyl)-4-methylhexyl Acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O3S
InChI InChI=1S/C11H20O3S/c1-5-8(2)11(15-10(4)13)6-7-14-9(3)12/h8,11H,5-7H2,1-4H3/t8-,11-/m1/s1
InChIKey CLOGDESPGCFJPG-LDYMZIIASA-N
Literature Reference DOI 10.1002/cbdv.200690103
Molecular Weight 232.338 g/mol
SMILES C(C)(=O)OCC[C@]([C@@](CC)(C)[H])(SC(=O)C)[H]
SPLASH splash10-0096-9800000000-f03470ab01d32e51044b
Source of Spectrum CBD-3-954-l_23
Synonyms (3R,4R)-3-(acetylthio)-4-methylhexyl acetate
Wiley ID 1793324