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Cyclohexanecarboxamide, N-[2'-(3-methoxy-1-propyn-1-yl)phenyl]-

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

Cyclohexanecarboxamide, N-[2'-(3-methoxy-1-propyn-1-yl)phenyl]-
SpectraBase Compound ID 5E5556oOtP
InChI InChI=1S/C17H21NO2/c1-20-13-7-11-14-8-5-6-12-16(14)18-17(19)15-9-3-2-4-10-15/h5-6,8,12,15H,2-4,9-10,13H2,1H3,(H,18,19)
InChIKey FHIUMMDLIAHTJD-UHFFFAOYSA-N
Mol Weight 271.36 g/mol
Molecular Formula C17H21NO2
Exact Mass 271.157229 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5drF2zOO6Ij
Name Cyclohexanecarboxamide, N-[2'-(3-methoxy-1-propyn-1-yl)phenyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 271.157228918 u
Formula C17H21NO2
InChI InChI=1S/C17H21NO2/c1-20-13-7-11-14-8-5-6-12-16(14)18-17(19)15-9-3-2-4-10-15/h5-6,8,12,15H,2-4,9-10,13H2,1H3,(H,18,19)
InChIKey FHIUMMDLIAHTJD-UHFFFAOYSA-N
Molecular Weight 271.360 g/mol
SMILES C1CC(C(NC=2C(C#CCOC)=CC=CC2)=O)CCC1