N-[1-[4-(1-anilino-2,2-dimethyl-propyl)phenyl]-2,2-dimethyl-propyl]aniline

SpectraBase Compound ID	B8r9Uerdcw8
InChI	InChI=1S/C28H36N2/c1-27(2,3)25(29-23-13-9-7-10-14-23)21-17-19-22(20-18-21)26(28(4,5)6)30-24-15-11-8-12-16-24/h7-20,25-26,29-30H,1-6H3
InChIKey	BUSHWTNLCSMIBX-UHFFFAOYSA-N Google Search
Mol Weight	400.6 g/mol
Molecular Formula	C28H36N2
Exact Mass	400.287849 g/mol

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SpectraBase Spectrum ID	DZriK7bUK9B
Name	N-[1-[4-(1-Anilino-2,2-dimethyl-propyl)phenyl]-2,2-dimethyl-propyl]aniline
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	400.287849167 u
Formula	C28H36N2
InChI	InChI=1S/C28H36N2/c1-27(2,3)25(29-23-13-9-7-10-14-23)21-17-19-22(20-18-21)26(28(4,5)6)30-24-15-11-8-12-16-24/h7-20,25-26,29-30H,1-6H3
InChIKey	BUSHWTNLCSMIBX-UHFFFAOYSA-N
Molecular Weight	400.610 g/mol
SMILES	C(NC1=CC=CC=C1)(C(C)(C)C)C1=CC=C(C(NC=2C=CC=CC2)C(C)(C)C)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR)	0.969692