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Acetic acid 1-(tris-methylsulfanyl-methyl)-dodecyl ester
SpectraBase Compound ID 2qWc3o6Mw8a
InChI InChI=1S/C18H36O2S3/c1-6-7-8-9-10-11-12-13-14-15-17(20-16(2)19)18(21-3,22-4)23-5/h17H,6-15H2,1-5H3
InChIKey GXQDIABNCZHIBD-UHFFFAOYSA-N
Mol Weight 380.7 g/mol
Molecular Formula C18H36O2S3
Exact Mass 380.187744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6cxm401I9at
Name Acetic acid 1-(tris-methylsulfanyl-methyl)-dodecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H36O2S3
InChI InChI=1S/C18H36O2S3/c1-6-7-8-9-10-11-12-13-14-15-17(20-16(2)19)18(21-3,22-4)23-5/h17H,6-15H2,1-5H3
InChIKey GXQDIABNCZHIBD-UHFFFAOYSA-N
Molecular Weight 380.664 g/mol
SMILES C(C(OC(=O)C)CCCCCCCCCCC)(SC)(SC)SC
SPLASH splash10-0hji-6498000000-6135508690cf568afd0b
Source of Spectrum AJ-71-1949-19
Synonyms 1-Tris(methylthio)methyl]dodecyl acetate 1-[tris(methylsulfanyl)methyl]dodecyl acetate
Wiley ID 774609