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N-(Benzyloxy)carbonyl)-2-(p-methylbenzyl)-3-pyrroline

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

N-(Benzyloxy)carbonyl)-2-(p-methylbenzyl)-3-pyrroline
SpectraBase Compound ID GSKHeHciXy3
InChI InChI=1S/C20H21NO2/c1-16-9-11-17(12-10-16)14-19-8-5-13-21(19)20(22)23-15-18-6-3-2-4-7-18/h2-12,19H,13-15H2,1H3
InChIKey FDKUCUDGFPLUDA-UHFFFAOYSA-N
Mol Weight 307.39 g/mol
Molecular Formula C20H21NO2
Exact Mass 307.157229 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HQsts5A8G8n
Name N-(Benzyloxy)carbonyl)-2-(p-methylbenzyl)-3-pyrroline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 307.157228918 u
Formula C20H21NO2
InChI InChI=1S/C20H21NO2/c1-16-9-11-17(12-10-16)14-19-8-5-13-21(19)20(22)23-15-18-6-3-2-4-7-18/h2-12,19H,13-15H2,1H3
InChIKey FDKUCUDGFPLUDA-UHFFFAOYSA-N
Molecular Weight 307.393 g/mol
SMILES C(N1C(C=CC1)CC1=CC=C(C=C1)C)(OCC1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.928854