For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-[2-(2-pyridyl)ethyl]tetrahydro-2-thiophenecarboxylic acid, methyl ester, 1,1-dioxide
SpectraBase Compound ID LslPFw4ao0S
InChI InChI=1S/C13H17NO4S/c1-18-12(15)13(7-4-10-19(13,16)17)8-6-11-5-2-3-9-14-11/h2-3,5,9H,4,6-8,10H2,1H3
InChIKey HQXNEWAFSGTSAK-UHFFFAOYSA-N
Mol Weight 283.34 g/mol
Molecular Formula C13H17NO4S
Exact Mass 283.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 80MSnKDzUin
Name 1,1-Diketo-2-[2-(2-pyridyl)ethyl]thiolane-2-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO4S
InChI InChI=1S/C13H17NO4S/c1-18-12(15)13(7-4-10-19(13,16)17)8-6-11-5-2-3-9-14-11/h2-3,5,9H,4,6-8,10H2,1H3
InChIKey HQXNEWAFSGTSAK-UHFFFAOYSA-N
Molecular Weight 283.342 g/mol
SMILES C1(CCCS1(=O)=O)(CCc1ccccn1)C(=O)OC
SPLASH splash10-052f-6900000000-b8341cdd1774392c9952
Source of Spectrum SO-0-454-5
Synonyms 1,1-Dioxo-2-[2-(2-pyridinyl)ethyl]-2-thiolanecarboxylic acid methyl ester Methyl 1,1-bis(oxidanylidene)-2-(2-pyridin-2-ylethyl)thiolane-2-carboxylate Methyl 1,1-dioxo-2-(2-pyridin-2-ylethyl)thiolane-2-carboxylate Methyl 1,1-dioxo-2-[2-(2-pyridyl)ethyl]thiolane-2-carboxylate
Wiley ID 1539367