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1,4-Benzenediol, 3-(octadecylthio)-2,5-dipropyl-

View entire compound with spectra: 1 MS (GC)

1,4-Benzenediol, 3-(octadecylthio)-2,5-dipropyl-
SpectraBase Compound ID IgKiUm7l8Ph
InChI InChI=1S/C30H54O2S/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-33-30-27(23-6-3)28(31)25-26(22-5-2)29(30)32/h25,31-32H,4-24H2,1-3H3
InChIKey GWORRKUGCWLBHN-UHFFFAOYSA-N
Mol Weight 478.8 g/mol
Molecular Formula C30H54O2S
Exact Mass 478.384452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LXeb5obkgbb
Name 1,4-Benzenediol, 3-(octadecylthio)-2,5-dipropyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H54O2S
InChI InChI=1S/C30H54O2S/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-33-30-27(23-6-3)28(31)25-26(22-5-2)29(30)32/h25,31-32H,4-24H2,1-3H3
InChIKey GWORRKUGCWLBHN-UHFFFAOYSA-N
Molecular Weight 478.820 g/mol
SMILES Oc1c(cc(c(c1SCCCCCCCCCCCCCCCCCC)CCC)O)CCC
SPLASH splash10-004i-6310900000-2b28b202eebb7936b1ba
Source of Spectrum JX-2015-4-827
Synonyms 3-(octadecylthio)-2,5-dipropylbenzene-1,4-diol 3-(octadecylsulfanyl)-2,5-dipropylbenzene-1,4-diol 3-Octadecylsulfanyl-2,5-dipropylbenzene-1,4-diol 3-Octadecylsulfanyl-2,5-dipropyl-benzene-1,4-diol
Wiley ID 1726243