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Methyl (E)-[1,4]oxathian-3-ylidene)acetate S-oxide
SpectraBase Compound ID JPoudZ1gbLa
InChI InChI=1S/C7H10O4S/c1-10-7(8)4-6-5-11-2-3-12(6)9/h4H,2-3,5H2,1H3/b6-4+
InChIKey JTZJKXCAPJHGGF-GQCTYLIASA-N
Mol Weight 190.21 g/mol
Molecular Formula C7H10O4S
Exact Mass 190.02998 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWRhYGOM11c
Name Methyl (E)-[1,4]oxathian-3-ylidene)acetate S-oxide
Alternate Name(s) (2E)-2-(4-oxo-1,4-oxathian-3-ylidene)acetic acid methyl ester methyl (2E)-2-(4-oxo-1,4-oxathian-3-ylidene)acetate methyl (2E)-2-(4-oxidanylidene-1,4-oxathian-3-ylidene)ethanoate
Comments Less than 3 mono-isotopic peaks
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Formula C7H10O4S
InChI InChI=1S/C7H10O4S/c1-10-7(8)4-6-5-11-2-3-12(6)9/h4H,2-3,5H2,1H3/b6-4+
InChIKey JTZJKXCAPJHGGF-GQCTYLIASA-N
Molecular Weight 190.213 g/mol
SMILES C1S(\C(COC1)=C/C(=O)OC)=O
SPLASH splash10-00di-0900000000-f0a50125c43286dab3fc
Source of Spectrum O1-62-275-7
Wiley ID 1592424