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9,10-di(methylsulfanyl)octadecan-11-olide
SpectraBase Compound ID DY6jQye7qzK
InChI InChI=1S/C20H38O2S2/c1-4-5-6-8-11-14-17-20(24-3)18(23-2)15-12-9-7-10-13-16-19(21)22-17/h17-18,20H,4-16H2,1-3H3
InChIKey DFBQYPUBSYFBPQ-UHFFFAOYSA-N
Mol Weight 374.6 g/mol
Molecular Formula C20H38O2S2
Exact Mass 374.231323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKWA9xVYfsM
Name 9,10-di(methylsulfanyl)octadecan-11-olide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H38O2S2
InChI InChI=1S/C20H38O2S2/c1-4-5-6-8-11-14-17-20(24-3)18(23-2)15-12-9-7-10-13-16-19(21)22-17/h17-18,20H,4-16H2,1-3H3
InChIKey DFBQYPUBSYFBPQ-UHFFFAOYSA-N
Instrument Name Agilent quadrupole
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.7b00366
Molecular Weight 374.642 g/mol
SMILES C1CC(C(C(OC(CCCCC1)=O)CCCCCCC)SC)SC
SPLASH splash10-0079-8903000000-bf0582386638d6f8be06
Source of Spectrum G4-80-2580-Figure 11C
Wiley ID 1872298