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3-Allyl-9-hydroxy-7-(4-methoxybenzyl)-3,5,6,7,8,9-hexahydrooxazolo[4,5-h]-[3]benzazepin-2-one
SpectraBase Compound ID EunJOLFINjo
InChI InChI=1S/C22H24N2O4/c1-3-9-24-19-11-16-8-10-23(13-15-4-6-17(27-2)7-5-15)14-20(25)18(16)12-21(19)28-22(24)26/h3-7,11-12,20,25H,1,8-10,13-14H2,2H3
InChIKey RGLYDQXMBWUFTA-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 5dbqZkvsALc
Name 3-Allyl-9-hydroxy-7-(4-methoxybenzyl)-3,5,6,7,8,9-hexahydrooxazolo[4,5-h]-[3]benzazepin-2-one
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N2O4
InChI InChI=1S/C22H24N2O4/c1-3-9-24-19-11-16-8-10-23(13-15-4-6-17(27-2)7-5-15)14-20(25)18(16)12-21(19)28-22(24)26/h3-7,11-12,20,25H,1,8-10,13-14H2,2H3
InChIKey RGLYDQXMBWUFTA-UHFFFAOYSA-N
Instrument Name Thermo-Finnigan MAT GCQ
Ionization Type EI
Literature Reference DOI 10.1002/ardp.202200147
Molecular Weight 380.444 g/mol
SMILES OC1CN(CCc2c1cc1OC(N(CC=C)c1c2)=O)Cc1ccc(cc1)OC
SPLASH splash10-03k9-0910000000-6221325af5e806062400
Source of Spectrum APC-355-15-21e
Thin-Layer Chromatography Rf = 0.17 (ethyl acetate/n-hexane, 2:1+0.5% N,N-dimethylethanamine)
Wiley ID 1875748