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(3S,4R,5R)-3-Pethylthiomethyl-4-vinyl-5-n-pentyl-.gamma.-butyrolactone
SpectraBase Compound ID Lr7Jb8TiseP
InChI InChI=1S/C18H24O2S/c1-3-5-7-12-17-15(4-2)16(18(19)20-17)13-21-14-10-8-6-9-11-14/h4,6,8-11,15-17H,2-3,5,7,12-13H2,1H3/t15-,16-,17-/m1/s1
InChIKey FDYLFGQCPLSVNG-BRWVUGGUSA-N
Mol Weight 304.45 g/mol
Molecular Formula C18H24O2S
Exact Mass 304.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G0PJvKeVdic
Name (3S,4R,5R)-3-Pethylthiomethyl-4-vinyl-5-n-pentyl-.gamma.-butyrolactone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O2S
InChI InChI=1S/C18H24O2S/c1-3-5-7-12-17-15(4-2)16(18(19)20-17)13-21-14-10-8-6-9-11-14/h4,6,8-11,15-17H,2-3,5,7,12-13H2,1H3/t15-,16-,17-/m1/s1
InChIKey FDYLFGQCPLSVNG-BRWVUGGUSA-N
Molecular Weight 304.448 g/mol
SMILES C1([C@@]([C@@](C=C)([C@](O1)(CCCCC)[H])[H])(CSc1ccccc1)[H])=O
SPLASH splash10-00sr-3901000000-f3d8fb678dbcdf32ee41
Source of Spectrum QC-7-1927-7
Synonyms (3R,4R,5R)-3-Phenylthiomethyl-4-vinyl-5-n-pentyl-.gamma.-butyrolactone
Wiley ID 869368