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2-(1-Thia-2,2-dicarbethoxypropyl)pyridine

View entire compound with spectra: 1 MS (GC)

2-(1-Thia-2,2-dicarbethoxypropyl)pyridine
SpectraBase Compound ID 64Qm1ilBT4f
InChI InChI=1S/C13H17NO4S/c1-4-17-11(15)13(3,12(16)18-5-2)19-10-8-6-7-9-14-10/h6-9H,4-5H2,1-3H3
InChIKey ZULPAUYGEJBPKP-UHFFFAOYSA-N
Mol Weight 283.34 g/mol
Molecular Formula C13H17NO4S
Exact Mass 283.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C9BRvSU4eUK
Name 2-(1-Thia-2,2-dicarbethoxypropyl)pyridine
CAS Registry Number 119391-50-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO4S
InChI InChI=1S/C13H17NO4S/c1-4-17-11(15)13(3,12(16)18-5-2)19-10-8-6-7-9-14-10/h6-9H,4-5H2,1-3H3
InChIKey ZULPAUYGEJBPKP-UHFFFAOYSA-N
Molecular Weight 283.342 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)(Sc1ncccc1)C
SPLASH splash10-03di-0930000000-2575f01fe0c874884bce
Source of Spectrum J-54-1830-8
Synonyms Diethyl 2-methyl-2-(2-pyridinylsulfanyl)malonate 2-Methyl-2-(2-pyridinylthio)propanedioic acid diethyl ester Diethyl 2-methyl-2-pyridin-2-ylsulfanylpropanedioate Diethyl 2-methyl-2-(2-pyridylsulfanyl)propanedioate Diethyl 2-methyl-2-pyridin-2-ylsulfanyl-propanedioate
Wiley ID 1286764