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1,4,7-Trioxa-11-thiacyclotetradecane-9,13-diol
SpectraBase Compound ID 2eFt83eR2jz
InChI InChI=1S/C10H20O5S/c11-9-5-14-3-1-13-2-4-15-6-10(12)8-16-7-9/h9-12H,1-8H2
InChIKey XGKAZQGVHPHTHB-UHFFFAOYSA-N
Mol Weight 252.32 g/mol
Molecular Formula C10H20O5S
Exact Mass 252.103145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3b4XbsSKchS
Name 1,4,7-Trioxa-11-thiacyclotetradecane-9,13-diol
Alternate Name(s) 9,13-Dihydroxy-1,4,7-trioxa-11-thiacyclotetradecane
CAS Registry Number 100228-56-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H20O5S
InChI InChI=1S/C10H20O5S/c11-9-5-14-3-1-13-2-4-15-6-10(12)8-16-7-9/h9-12H,1-8H2
InChIKey XGKAZQGVHPHTHB-UHFFFAOYSA-N
Molecular Weight 252.325 g/mol
SMILES OC1CSCC(COCCOCCOC1)O
SPLASH splash10-0072-9200000000-146f96c285da265bd7a7
Source of Spectrum J-51-1129-2
Wiley ID 1255054