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1-Acetyl-4-{3,5-dimethyl-4-[(2-nitrophenyl)methoxy]phenyl}-1,2,3,6-tetrahydropyridine
SpectraBase Compound ID IgIA6vpcAmq
InChI InChI=1S/C22H24N2O4/c1-15-12-20(18-8-10-23(11-9-18)17(3)25)13-16(2)22(15)28-14-19-6-4-5-7-21(19)24(26)27/h4-8,12-13H,9-11,14H2,1-3H3
InChIKey HZUMGAJMCNOETI-UHFFFAOYSA-N
Mol Weight 380.44 g/mol
Molecular Formula C22H24N2O4
Exact Mass 380.173607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzVpTGXvJRY
Name 1-Acetyl-4-{3,5-dimethyl-4-[(2-nitrophenyl)methoxy]phenyl}-1,2,3,6-tetrahydropyridine
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N2O4
InChI InChI=1S/C22H24N2O4/c1-15-12-20(18-8-10-23(11-9-18)17(3)25)13-16(2)22(15)28-14-19-6-4-5-7-21(19)24(26)27/h4-8,12-13H,9-11,14H2,1-3H3
InChIKey HZUMGAJMCNOETI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.19970800516
Molecular Weight 380.444 g/mol
SMILES C1CC(=CCN1C(=O)C)c1cc(c(c(c1)C)OCc1c(cccc1)[N+](=O)[O-])C
SPLASH splash10-0udl-3491000000-35e9d2e04c5773a326ef
Source of Spectrum H-80-1578-18
Synonyms 1-(4-(3,5-dimethyl-4-((2-nitrobenzyl)oxy)phenyl)-3,6-dihydropyridin-1(2H)-yl)ethan-1-one
Wiley ID 1785298