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2-[10,11-bis(methylsulfanyl)heptadecyl]benzene-1,4-diol
SpectraBase Compound ID 8D7SMRhIjgu
InChI InChI=1S/C25H44O2S2/c1-4-5-6-13-16-24(28-2)25(29-3)17-14-11-9-7-8-10-12-15-21-20-22(26)18-19-23(21)27/h18-20,24-27H,4-17H2,1-3H3
InChIKey WDNFFIGCSJJJBK-UHFFFAOYSA-N
Mol Weight 440.7 g/mol
Molecular Formula C25H44O2S2
Exact Mass 440.278273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GU7K4wbssb5
Name 2-[10,11-bis(methylsulfanyl)heptadecyl]benzene-1,4-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H44O2S2
InChI InChI=1S/C25H44O2S2/c1-4-5-6-13-16-24(28-2)25(29-3)17-14-11-9-7-8-10-12-15-21-20-22(26)18-19-23(21)27/h18-20,24-27H,4-17H2,1-3H3
InChIKey WDNFFIGCSJJJBK-UHFFFAOYSA-N
Molecular Weight 440.745 g/mol
SMILES Oc1cc(c(cc1)O)CCCCCCCCCC(C(SC)CCCCCC)SC
SPLASH splash10-00b9-0907000000-5587e83078129ee72394
Source of Spectrum G4-61-289-0
Synonyms 2-[10,11-bis(methylthio)heptadecyl]benzene-1,4-diol 2-[10,11-Bis(methylthio)heptadecyl]hydroquinone
Wiley ID 1607158