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1-((2-(Benzylamino)phenyl)ethynyl)cyclohexan-1-ol
SpectraBase Compound ID LEjv3NrvoiB
InChI InChI=1S/C21H23NO/c23-21(14-7-2-8-15-21)16-13-19-11-5-6-12-20(19)22-17-18-9-3-1-4-10-18/h1,3-6,9-12,22-23H,2,7-8,14-15,17H2
InChIKey CRPPOCXDXFXWKA-UHFFFAOYSA-N
Mol Weight 305.42 g/mol
Molecular Formula C21H23NO
Exact Mass 305.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5PlezGF5LPv
Name 1-((2-(Benzylamino)phenyl)ethynyl)cyclohexan-1-ol
Appearance Orange solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 305.177964364 u
Formula C21H23NO
GC Column SE-30 (30 m)
InChI InChI=1S/C21H23NO/c23-21(14-7-2-8-15-21)16-13-19-11-5-6-12-20(19)22-17-18-9-3-1-4-10-18/h1,3-6,9-12,22-23H,2,7-8,14-15,17H2
InChIKey CRPPOCXDXFXWKA-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201706067
Molecular Weight 305.421 g/mol
Quality 113
SMILES OC1(C#CC=2C=CC=CC2NCC2=CC=CC=C2)CCCCC1
SPLASH splash10-08g3-2091000000-b016cdab3ac63db96c42
Source of Spectrum QE-24-SM6-1f (DOI: 10.1002/chem.201706067)
Wiley ID 1900172