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5-(2-ketooxathiolan-3-yl)valeric acid methyl ester
SpectraBase Compound ID BnylLtzGiHu
InChI InChI=1S/C9H16O4S/c1-12-9(10)5-3-2-4-8-6-7-13-14(8)11/h8H,2-7H2,1H3
InChIKey KXEDWPVUUQOUOX-UHFFFAOYSA-N
Mol Weight 220.28 g/mol
Molecular Formula C9H16O4S
Exact Mass 220.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FPceM34KDEJ
Name 5-(2-ketooxathiolan-3-yl)valeric acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O4S
InChI InChI=1S/C9H16O4S/c1-12-9(10)5-3-2-4-8-6-7-13-14(8)11/h8H,2-7H2,1H3
InChIKey KXEDWPVUUQOUOX-UHFFFAOYSA-N
Molecular Weight 220.283 g/mol
SMILES C1OS(C(C1)CCCCC(=O)OC)=O
SPLASH splash10-05aj-9200000000-e4afb255b6a558530163
Synonyms 5-(2-oxo-3-oxathiolanyl)pentanoic acid methyl ester 5-(2-Oxo-[1,2]oxathiolan-3-yl)pentanoic acid, methyl ester Methyl 5-(2-oxidanylidene-1,2-oxathiolan-3-yl)pentanoate Methyl 5-(2-oxido-1,2-oxathiolan-3-yl)pentanoate Methyl 5-(2-oxooxathiolan-3-yl)pentanoate
Wiley ID 1488685