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4,4-Dimethyl-6-(morpholinomethyl)cyclohex-2-en-1-one

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

4,4-Dimethyl-6-(morpholinomethyl)cyclohex-2-en-1-one
SpectraBase Compound ID 4BbZuQDN29a
InChI InChI=1S/C13H21NO2/c1-13(2)4-3-12(15)11(9-13)10-14-5-7-16-8-6-14/h3-4,11H,5-10H2,1-2H3
InChIKey RURXQVBLQIUODH-UHFFFAOYSA-N
Mol Weight 223.32 g/mol
Molecular Formula C13H21NO2
Exact Mass 223.157229 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8JYfY7H4k6
Name 4,4-Dimethyl-6-(morpholinomethyl)cyclohex-2-en-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 223.157228918 u
Formula C13H21NO2
InChI InChI=1S/C13H21NO2/c1-13(2)4-3-12(15)11(9-13)10-14-5-7-16-8-6-14/h3-4,11H,5-10H2,1-2H3
InChIKey RURXQVBLQIUODH-UHFFFAOYSA-N
Molecular Weight 223.316 g/mol
SMILES C1(C=CC(CC1CN1CCOCC1)(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.907434