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3-[(3'-(Phenylsulfanyl)thiolanyl]propane-1,3-diol
SpectraBase Compound ID 1C6xDH8ckHi
InChI InChI=1S/C13H18O2S2/c14-8-6-12(15)13(7-9-16-10-13)17-11-4-2-1-3-5-11/h1-5,12,14-15H,6-10H2
InChIKey SQNPEDZIENTGIQ-UHFFFAOYSA-N
Mol Weight 270.4 g/mol
Molecular Formula C13H18O2S2
Exact Mass 270.074822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2pugMgq1Lc
Name 3-[(3'-(Phenylsulfanyl)thiolanyl]propane-1,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2S2
InChI InChI=1S/C13H18O2S2/c14-8-6-12(15)13(7-9-16-10-13)17-11-4-2-1-3-5-11/h1-5,12,14-15H,6-10H2
InChIKey SQNPEDZIENTGIQ-UHFFFAOYSA-N
Molecular Weight 270.405 g/mol
SMILES OCCC(C1(Sc2ccccc2)CCSC1)O
SPLASH splash10-0079-9270000000-cff2605a943f3f795109
Source of Spectrum KC-0-1912-59
Synonyms 1-[3-(phenylthio)-3-thiolanyl]propane-1,3-diol 1-(3-phenylsulfanyltetrahydrothiophen-3-yl)propane-1,3-diol 1-(3-phenylsulfanylthiolan-3-yl)propane-1,3-diol
Wiley ID 831124