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(-)-N-benzoylcytisine

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

(-)-N-benzoylcytisine
SpectraBase Compound ID 5xKNG5cicyF
InChI InChI=1S/C18H18N2O2/c21-17-8-4-7-16-15-9-13(11-20(16)17)10-19(12-15)18(22)14-5-2-1-3-6-14/h1-8,13,15H,9-12H2/t13-,15+/m0/s1
InChIKey HODDQHCNQOBZKP-DZGCQCFKSA-N
Mol Weight 294.35 g/mol
Molecular Formula C18H18N2O2
Exact Mass 294.136828 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 16k6o88IOz8
Name (-)-N-benzoylcytisine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.136827826 u
Formula C18H18N2O2
InChI InChI=1S/C18H18N2O2/c21-17-8-4-7-16-15-9-13(11-20(16)17)10-19(12-15)18(22)14-5-2-1-3-6-14/h1-8,13,15H,9-12H2/t13-,15+/m0/s1
InChIKey HODDQHCNQOBZKP-DZGCQCFKSA-N
Molecular Weight 294.354 g/mol
SMILES [C@@]12([H])CN(C[C@]([H])(C=3N(C2)C(=O)C=CC3)C1)C(C1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951735