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Acetic acid 1-methylsulfanylcarbonyl-dodecyl ester
SpectraBase Compound ID HYAnUHgLIVB
InChI InChI=1S/C16H30O3S/c1-4-5-6-7-8-9-10-11-12-13-15(16(18)20-3)19-14(2)17/h15H,4-13H2,1-3H3
InChIKey CNTPDVQPKXRCNY-UHFFFAOYSA-N
Mol Weight 302.47 g/mol
Molecular Formula C16H30O3S
Exact Mass 302.191566 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2TYENognnsf
Name Acetic acid 1-methylsulfanylcarbonyl-dodecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H30O3S
InChI InChI=1S/C16H30O3S/c1-4-5-6-7-8-9-10-11-12-13-15(16(18)20-3)19-14(2)17/h15H,4-13H2,1-3H3
InChIKey CNTPDVQPKXRCNY-UHFFFAOYSA-N
Molecular Weight 302.473 g/mol
SMILES C(C(OC(=O)C)CCCCCCCCCCC)(=O)SC
SPLASH splash10-0a4i-9670000000-8a3df081e93229ad7022
Source of Spectrum AJ-71-1950-21
Synonyms 1-[(methylsulfanyl)carbonyl]dodecyl acetate S-Methyl 2-Acetyl-1-tridecanethioacetate
Wiley ID 774603