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2-(Benzo[d][1,3]dioxol-5-yl)-N-(tert-butyl)-2-(3-oxo-2,3-dihydrobenzo[f][1,4]oxazepin-4(5H)-yl)acetamide
SpectraBase Compound ID Ll97hCFaA6L
InChI InChI=1S/C22H24N2O5/c1-22(2,3)23-21(26)20(14-8-9-17-18(10-14)29-13-28-17)24-11-15-6-4-5-7-16(15)27-12-19(24)25/h4-10,20H,11-13H2,1-3H3,(H,23,26)
InChIKey MUOPSFUQGLAGRO-UHFFFAOYSA-N
Mol Weight 396.44 g/mol
Molecular Formula C22H24N2O5
Exact Mass 396.168522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7MWjBsux3Nr
Name 2-(Benzo[d][1,3]dioxol-5-yl)-N-(tert-butyl)-2-(3-oxo-2,3-dihydrobenzo[f][1,4]oxazepin-4(5H)-yl)acetamide
Appearance White solid
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Formula C22H24N2O5
InChI InChI=1S/C22H24N2O5/c1-22(2,3)23-21(26)20(14-8-9-17-18(10-14)29-13-28-17)24-11-15-6-4-5-7-16(15)27-12-19(24)25/h4-10,20H,11-13H2,1-3H3,(H,23,26)
InChIKey MUOPSFUQGLAGRO-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.16
Molecular Weight 396.443 g/mol
Reported Formula C22H24N2O5
SMILES N(C(C(N1Cc2c(cccc2)OCC1=O)c1ccc2c(c1)OCO2)=O)C(C)(C)C
SPLASH splash10-03di-0900000000-07e94aa7eb29238446c4
Source of Spectrum BJO-10-SM6-10c
Thin-Layer Chromatography Rf = 0.65 (PE/AcOEt, 50:50)
Wiley ID 1853895