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

*Links on SpectraBase are not permalinks.

2-Azabutan-3-one, 1-(1-methylazacyclohex-2-yl)-2-methyl-4-(3,4-dichlorophenyl)-

View entire compound with spectra: 1 NMR, and 2 MS (GC)

2-Azabutan-3-one, 1-(1-methylazacyclohex-2-yl)-2-methyl-4-(3,4-dichlorophenyl)-
SpectraBase Compound ID 3noLiDJ4U9D
InChI InChI=1S/C16H22Cl2N2O/c1-19-8-4-3-5-13(19)11-20(2)16(21)10-12-6-7-14(17)15(18)9-12/h6-7,9,13H,3-5,8,10-11H2,1-2H3
InChIKey TYCTYGPDTUFLMG-UHFFFAOYSA-N
Mol Weight 329.27 g/mol
Molecular Formula C16H22Cl2N2O
Exact Mass 328.110919 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 7aNyxATtyDi
Name 2-Azabutan-3-one, 1-(1-methylazacyclohex-2-yl)-2-methyl-4-(3,4-dichlorophenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 328.110918735 u
Formula C16H22Cl2N2O
InChI InChI=1S/C16H22Cl2N2O/c1-19-8-4-3-5-13(19)11-20(2)16(21)10-12-6-7-14(17)15(18)9-12/h6-7,9,13H,3-5,8,10-11H2,1-2H3
InChIKey TYCTYGPDTUFLMG-UHFFFAOYSA-N
Molecular Weight 329.271 g/mol
SMILES C1CCCC(N1C)CN(C(CC1=CC(=C(C=C1)Cl)Cl)=O)C