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4-Methoxycarbonyl-3,5-diphenyl-1-pyrroline
SpectraBase Compound ID FwgiY6EJcjC
InChI InChI=1S/C18H17NO2/c1-21-18(20)16-15(13-8-4-2-5-9-13)12-19-17(16)14-10-6-3-7-11-14/h2-12,15-17H,1H3
InChIKey ASARVIYRSZDLHI-UHFFFAOYSA-N
Mol Weight 279.34 g/mol
Molecular Formula C18H17NO2
Exact Mass 279.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C0di4OxtLi4
Name 4-Methoxycarbonyl-3,5-diphenyl-1-pyrroline
CAS Registry Number 113298-17-2
Comments Edited after expert review for CHCl3 contamination - Original record with SpectrumID 1283185 moved to the Legacy library
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO2
InChI InChI=1S/C18H17NO2/c1-21-18(20)16-15(13-8-4-2-5-9-13)12-19-17(16)14-10-6-3-7-11-14/h2-12,15-17H,1H3
InChIKey ASARVIYRSZDLHI-UHFFFAOYSA-N
Molecular Weight 279.339 g/mol
SMILES C1(C(N=CC1c1ccccc1)c1ccccc1)C(=O)OC
SPLASH splash10-066r-2910000000-45bc8768537648057788
Source of Spectrum AJ-60-3364-2
Synonyms Methyl 2,4-diphenyl-3,4-dihydro-2H-pyrrole-3-carboxylate
Wiley ID 1821444