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1-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-carbonyl)isonipecotic acid
SpectraBase Compound ID DqtG3fHXzBu
InChI InChI=1S/C13H15NO5S/c15-12(14-3-1-8(2-4-14)13(16)17)11-10-9(7-20-11)18-5-6-19-10/h7-8H,1-6H2,(H,16,17)
InChIKey YIRDTHLWXGZYPQ-UHFFFAOYSA-N
Mol Weight 297.33 g/mol
Molecular Formula C13H15NO5S
Exact Mass 297.067094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3OEPQRf01oz
Name 1-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-carbonyl)isonipecotic acid
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Formula C13H15NO5S
InChI InChI=1S/C13H15NO5S/c15-12(14-3-1-8(2-4-14)13(16)17)11-10-9(7-20-11)18-5-6-19-10/h7-8H,1-6H2,(H,16,17)
InChIKey YIRDTHLWXGZYPQ-UHFFFAOYSA-N
Molecular Weight 297.325 g/mol
SMILES OC(C1CCN(C(c2c3c(OCCO3)cs2)=O)CC1)=O
SPLASH splash10-014m-9810000000-017d68a3210999c0d540
Synonyms 1-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-ylcarbonyl)piperidine-4-carboxylic acid 1-(2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carbonyl)piperidine-4-carboxylic acid 1-[2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl(oxo)methyl]-4-piperidinecarboxylic acid Piperidine-4-carboxylic acid, 1-(2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carbonyl)-
Wiley ID 1439647