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N-(2,6-Dimethylphenyl)-2-(9-methoxy-3-oxo-2,3-dihydrobenzo[f][1,4]oxazepin-4(5H)-yl)-2-phenylacetamide
SpectraBase Compound ID KiDyCwenzgL
InChI InChI=1S/C26H26N2O4/c1-17-9-7-10-18(2)23(17)27-26(30)24(19-11-5-4-6-12-19)28-15-20-13-8-14-21(31-3)25(20)32-16-22(28)29/h4-14,24H,15-16H2,1-3H3,(H,27,30)
InChIKey ZRXYTGSHITZJJB-UHFFFAOYSA-N
Mol Weight 430.5 g/mol
Molecular Formula C26H26N2O4
Exact Mass 430.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Id816a7fdQH
Name N-(2,6-Dimethylphenyl)-2-(9-methoxy-3-oxo-2,3-dihydrobenzo[f][1,4]oxazepin-4(5H)-yl)-2-phenylacetamide
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26N2O4
InChI InChI=1S/C26H26N2O4/c1-17-9-7-10-18(2)23(17)27-26(30)24(19-11-5-4-6-12-19)28-15-20-13-8-14-21(31-3)25(20)32-16-22(28)29/h4-14,24H,15-16H2,1-3H3,(H,27,30)
InChIKey ZRXYTGSHITZJJB-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.16
Molecular Weight 430.504 g/mol
Reported Formula C26H26N2O4
SMILES N(C(C(N1Cc2c(c(ccc2)OC)OCC1=O)c1ccccc1)=O)c1c(cccc1C)C
SPLASH splash10-0006-9110000000-eade4874dcae69aecb22
Source of Spectrum BJO-10-SM10-10j
Thin-Layer Chromatography Rf = 0.26 (PE/AcOEt, 50:50)
Wiley ID 1853900