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

*Links on SpectraBase are not permalinks.
1-(1,1-Dioxo-1H-benzo[d]isothiazol-3-yl)-piperidine-4-carboxylic acid ethyl ester
SpectraBase Compound ID KqeIWFpN6dg
InChI InChI=1S/C15H18N2O4S/c1-2-21-15(18)11-7-9-17(10-8-11)14-12-5-3-4-6-13(12)22(19,20)16-14/h3-6,11H,2,7-10H2,1H3
InChIKey IXQYLXWVHWRYMB-UHFFFAOYSA-N
Mol Weight 322.38 g/mol
Molecular Formula C15H18N2O4S
Exact Mass 322.098728 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 3txGb3JzAJa
Name 1-(1,1-Dioxo-1H-benzo[d]isothiazol-3-yl)-piperidine-4-carboxylic acid ethyl ester
Alternate Name(s) 1-(1,1-diketo-1,2-benzothiazol-3-yl)isonipecotic acid ethyl ester 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-4-piperidinecarboxylic acid ethyl ester Ethyl 1-(1,1-dioxido-1,2-benzisothiazol-3-yl)-4-piperidinecarboxylate Ethyl 1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-4-carboxylate Ethyl 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]piperidine-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18N2O4S
InChI InChI=1S/C15H18N2O4S/c1-2-21-15(18)11-7-9-17(10-8-11)14-12-5-3-4-6-13(12)22(19,20)16-14/h3-6,11H,2,7-10H2,1H3
InChIKey IXQYLXWVHWRYMB-UHFFFAOYSA-N
Molecular Weight 322.379 g/mol
SMILES CCOC(C1CCN(C2=NS(c3c2cccc3)(=O)=O)CC1)=O
SPLASH splash10-0a59-5930000000-6bbed8c8ecb4dbca5f43
Wiley ID 1458249