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3-(1-hydroxycyclohexyl)-N,N-diphenyl-2-propynamide

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

3-(1-hydroxycyclohexyl)-N,N-diphenyl-2-propynamide
SpectraBase Compound ID GVfdAN09ZJ2
InChI InChI=1S/C21H21NO2/c23-20(14-17-21(24)15-8-3-9-16-21)22(18-10-4-1-5-11-18)19-12-6-2-7-13-19/h1-2,4-7,10-13,24H,3,8-9,15-16H2
InChIKey BKIQZBPMXKZEBQ-UHFFFAOYSA-N
Mol Weight 319.4 g/mol
Molecular Formula C21H21NO2
Exact Mass 319.157229 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9fVjDKy9ump
Name 3-(1-Hydroxycyclohexyl)-N,N-diphenyl-2-propynamide
Comments Computed using HOSE algorithm
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Exact Mass 319.157228918 u
Formula C21H21NO2
InChI InChI=1S/C21H21NO2/c23-20(14-17-21(24)15-8-3-9-16-21)22(18-10-4-1-5-11-18)19-12-6-2-7-13-19/h1-2,4-7,10-13,24H,3,8-9,15-16H2
InChIKey BKIQZBPMXKZEBQ-UHFFFAOYSA-N
Molecular Weight 319.404 g/mol
SMILES C(C(N(C=1C=CC=CC1)C1=CC=CC=C1)=O)#CC1(O)CCCCC1