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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1OYBbp6n0ea
Name 3-(1-hydroxycyclohexyl)-N,N-diphenyl-2-propynamide
Alternate Name(s) 3-(1-hydroxycyclohexyl)-N,N-diphenylprop-2-ynamide 3-(1-hydroxycyclohexyl)-N,N-diphenyl-prop-2-ynamide 3-(1-oxidanylcyclohexyl)-N,N-diphenyl-prop-2-ynamide
Comments Less than 3 mono-isotopic peaks
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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 OC1(C#CC(N(c2ccccc2)c2ccccc2)=O)CCCCC1
SPLASH splash10-0uxr-9006000000-313980db8d7b253007df
Source of Spectrum K-126-830-17
Wiley ID 1319533