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1,3-Butanediol cyclic sulfate
SpectraBase Compound ID LiivX2InXyu
InChI InChI=1S/C4H8O4S/c1-4-2-3-7-9(5,6)8-4/h4H,2-3H2,1H3
InChIKey KLXMOOWASHTDLR-UHFFFAOYSA-N
Mol Weight 152.16 g/mol
Molecular Formula C4H8O4S
Exact Mass 152.01433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AznwpcPO30a
Name 1,3,2-Dioxathiane, 4-methyl-, 2,2-dioxide
Alternate Name(s) 1,3-Butanediol, cyclic sulfate 1,3-Butylene sulfate 1-Methyltrimethylene sulfate 4-Methyl-1,3,2-dioxathiane 2,2-dioxide BRN 1238505
CAS Registry Number 4426-50-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H8O4S
InChI InChI=1S/C4H8O4S/c1-4-2-3-7-9(5,6)8-4/h4H,2-3H2,1H3
InChIKey KLXMOOWASHTDLR-UHFFFAOYSA-N
Molecular Weight 152.164 g/mol
SMILES C1(OS(OCC1)(=O)=O)C
SPLASH splash10-0006-9000000000-5ec808fbebe9ce977050
Source of Spectrum B-30-571-1
Wiley ID 1148442