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N-Benzyl-2-(tert-butyl)-2-(9-methoxy-3-oxo-2,3-dihydrobenzo[f][1,4]oxazepin-4(5H)-yl)acetamide
SpectraBase Compound ID 3ozwH0mcKfn
InChI InChI=1S/C23H28N2O4/c1-23(2,3)21(22(27)24-13-16-9-6-5-7-10-16)25-14-17-11-8-12-18(28-4)20(17)29-15-19(25)26/h5-12,21H,13-15H2,1-4H3,(H,24,27)
InChIKey UKHIBTFTKJMSOK-UHFFFAOYSA-N
Mol Weight 396.49 g/mol
Molecular Formula C23H28N2O4
Exact Mass 396.204907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 69AVRVzIciF
Name N-Benzyl-2-(tert-butyl)-2-(9-methoxy-3-oxo-2,3-dihydrobenzo[f][1,4]oxazepin-4(5H)-yl)acetamide
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28N2O4
InChI InChI=1S/C23H28N2O4/c1-23(2,3)21(22(27)24-13-16-9-6-5-7-10-16)25-14-17-11-8-12-18(28-4)20(17)29-15-19(25)26/h5-12,21H,13-15H2,1-4H3,(H,24,27)
InChIKey UKHIBTFTKJMSOK-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.16
Molecular Weight 396.487 g/mol
Reported Formula C23H28N2O4
SMILES N(C(C(N1Cc2c(c(ccc2)OC)OCC1=O)C(C)(C)C)=O)Cc1ccccc1
SPLASH splash10-0006-9600000000-c8ed56654c4772408d3d
Source of Spectrum BJO-10-SM9-10h
Thin-Layer Chromatography Rf = 0.53 (PE/AcOEt, 66:34)
Wiley ID 1853898