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3,5-Di-tert-Butyl-1-benzyl-2,7-dihydro-1H-azepine
SpectraBase Compound ID 96JsCjiSgUg
InChI InChI=1S/C21H31N/c1-20(2,3)18-12-13-22(15-17-10-8-7-9-11-17)16-19(14-18)21(4,5)6/h7-12,14H,13,15-16H2,1-6H3
InChIKey FAXRHCVICDKEBM-UHFFFAOYSA-N
Mol Weight 297.49 g/mol
Molecular Formula C21H31N
Exact Mass 297.24565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2y1qBAWI4f
Name 3,5-Di-tert-Butyl-1-benzyl-2,7-dihydro-1H-azepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31N
InChI InChI=1S/C21H31N/c1-20(2,3)18-12-13-22(15-17-10-8-7-9-11-17)16-19(14-18)21(4,5)6/h7-12,14H,13,15-16H2,1-6H3
InChIKey FAXRHCVICDKEBM-UHFFFAOYSA-N
Molecular Weight 297.486 g/mol
SMILES C1N(CC=C(C=C1C(C)(C)C)C(C)(C)C)Cc1ccccc1
SPLASH splash10-0006-9060000000-2b22b83cdc21d42017ed
Source of Spectrum KC-0-3662-0
Synonyms 1-Benzyl-3,5-ditert-butyl-2,7-dihydro-1H-azepine
Wiley ID 829623