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N-(t-Butyl)-N'-[2-(perhydroazepin-1'-yl)phenyl] urea
SpectraBase Compound ID ILmdB4Hv0CG
InChI InChI=1S/C17H27N3O/c1-17(2,3)19-16(21)18-14-10-6-7-11-15(14)20-12-8-4-5-9-13-20/h6-7,10-11H,4-5,8-9,12-13H2,1-3H3,(H2,18,19,21)
InChIKey YNSIIBRGMLHLNH-UHFFFAOYSA-N
Mol Weight 289.42 g/mol
Molecular Formula C17H27N3O
Exact Mass 289.215413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7AxuJkfFMl9
Name N-(t-Butyl)-N'-[2-(perhydroazepin-1'-yl)phenyl] urea
CAS Registry Number 140410-89-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H27N3O
InChI InChI=1S/C17H27N3O/c1-17(2,3)19-16(21)18-14-10-6-7-11-15(14)20-12-8-4-5-9-13-20/h6-7,10-11H,4-5,8-9,12-13H2,1-3H3,(H2,18,19,21)
InChIKey YNSIIBRGMLHLNH-UHFFFAOYSA-N
Molecular Weight 289.423 g/mol
SMILES N(C(NC(C)(C)C)=O)c1c(N2CCCCCC2)cccc1
SPLASH splash10-014s-1900000000-ba0d6c0235afc521579b
Source of Spectrum K-125-1847-7
Synonyms N-(tert-butyl)-N'-(2-hexahydro-1H-azepin-1-ylphenyl)urea 1-[2-(1-azepanyl)phenyl]-3-tert-butylurea 1-[2-(azepan-1-yl)phenyl]-3-tert-butylurea
Wiley ID 1292797