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N-(5,5-dimethyl-3-oxo-1-cyclohexen-1-yl)-beta-alanine, ethyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

N-(5,5-dimethyl-3-oxo-1-cyclohexen-1-yl)-beta-alanine, ethyl ester
SpectraBase Compound ID Hz4FwOlfRHo
InChI InChI=1S/C13H21NO3/c1-4-17-12(16)5-6-14-10-7-11(15)9-13(2,3)8-10/h7,14H,4-6,8-9H2,1-3H3
InChIKey USABFYMIXMBSOK-UHFFFAOYSA-N
Mol Weight 239.31 g/mol
Molecular Formula C13H21NO3
Exact Mass 239.152144 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 9IPXnxtulJJ
Name N-(5,5-DIMETHYL-3-OXO-1-CYCLOHEXEN-1-YL)-beta-ALANINE, ETHYL ESTER
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number J 3
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21NO3
InChI InChI=1S/C13H21NO3/c1-4-17-12(16)5-6-14-10-7-11(15)9-13(2,3)8-10/h7,14H,4-6,8-9H2,1-3H3
InChIKey USABFYMIXMBSOK-UHFFFAOYSA-N
Melting Point 138C
Molecular Weight 239.315002
Synonyms B-ALANINE, N-/5,5-DIMETHYL-3-OXO- 1-CYCLOHEXEN-1-YL/-, ETHYL ESTER
Technique KBr WAFER