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(1RS,2RS)-1-[1-(4-Methoxyphenylsulfanyl)cyclohexyl]-2-methylpropane-1,3-diol
SpectraBase Compound ID 3jLRw5wss30
InChI InChI=1S/C17H26O3S/c1-13(12-18)16(19)17(10-4-3-5-11-17)21-15-8-6-14(20-2)7-9-15/h6-9,13,16,18-19H,3-5,10-12H2,1-2H3
InChIKey GPDHJOGRMGZWAC-UHFFFAOYSA-N
Mol Weight 310.45 g/mol
Molecular Formula C17H26O3S
Exact Mass 310.160266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DtfJWuMajgo
Name (1RS,2RS)-1-[1-(4-Methoxyphenylsulfanyl)cyclohexyl]-2-methylpropane-1,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O3S
InChI InChI=1S/C17H26O3S/c1-13(12-18)16(19)17(10-4-3-5-11-17)21-15-8-6-14(20-2)7-9-15/h6-9,13,16,18-19H,3-5,10-12H2,1-2H3
InChIKey GPDHJOGRMGZWAC-UHFFFAOYSA-N
Molecular Weight 310.452 g/mol
SMILES OCC(C(C1(Sc2ccc(cc2)OC)CCCCC1)O)C
SPLASH splash10-001u-9300000000-54f44af3d46b14c3a179
Source of Spectrum KC-0-369-30
Synonyms 1-{1-[(4-methoxyphenyl)sulfanyl]cyclohexyl}-2-methyl-1,3-propanediol
Wiley ID 785043