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1,3-Dithiane-2-ethanol, 2-(3-furanyl)-, 4-methylbenzenesulfonate
SpectraBase Compound ID CUi8YNfIQ49
InChI InChI=1S/C17H20O4S3/c1-14-3-5-16(6-4-14)24(18,19)21-10-8-17(15-7-9-20-13-15)22-11-2-12-23-17/h3-7,9,13H,2,8,10-12H2,1H3
InChIKey XYQUWLHPAGAPKH-UHFFFAOYSA-N
Mol Weight 384.52 g/mol
Molecular Formula C17H20O4S3
Exact Mass 384.052373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vIXNkdf8TR
Name 1,3-Dithiane-2-ethanol, 2-(3-furanyl)-, 4-methylbenzenesulfonate
CAS Registry Number 72877-90-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O4S3
InChI InChI=1S/C17H20O4S3/c1-14-3-5-16(6-4-14)24(18,19)21-10-8-17(15-7-9-20-13-15)22-11-2-12-23-17/h3-7,9,13H,2,8,10-12H2,1H3
InChIKey XYQUWLHPAGAPKH-UHFFFAOYSA-N
Molecular Weight 384.523 g/mol
SMILES c1(S(=O)(=O)OCCC2(c3cocc3)SCCCS2)ccc(cc1)C
SPLASH splash10-08g0-0930000000-6cb7a92c4642d8719974
Source of Spectrum C-103-3119-0
Synonyms 2-(3-Furyl)-2-(2-(tosyloxy)ethyl)-1,3-dithiane 2-[2-(3-furyl)-1,3-dithian-2-yl]ethyl 4-methylbenzenesulfonate
Wiley ID 1361332