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3,5-Ditert-butyl-4-hydroxybenzaldehyde (4-bromophenyl)hydrazone

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3,5-Ditert-butyl-4-hydroxybenzaldehyde (4-bromophenyl)hydrazone
SpectraBase Compound ID 2KPcJiIJQ4O
InChI InChI=1S/C21H27BrN2O/c1-20(2,3)17-11-14(12-18(19(17)25)21(4,5)6)13-23-24-16-9-7-15(22)8-10-16/h7-13,24-25H,1-6H3/b23-13+
InChIKey REAMCLUSTPYPJY-YDZHTSKRSA-N
Mol Weight 403.36 g/mol
Molecular Formula C21H27BrN2O
Exact Mass 402.130676 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 85UtOd6lSJE
Name 3,5-Ditert-butyl-4-hydroxybenzaldehyde (4-bromophenyl)hydrazone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 402.130676496 u
Formula C21H27BrN2O
InChI InChI=1S/C21H27BrN2O/c1-20(2,3)17-11-14(12-18(19(17)25)21(4,5)6)13-23-24-16-9-7-15(22)8-10-16/h7-13,24-25H,1-6H3/b23-13+
InChIKey REAMCLUSTPYPJY-YDZHTSKRSA-N
Molecular Weight 403.364 g/mol
SMILES C1(=C(C(C)(C)C)C=C(C=C1C(C)(C)C)\C=N\NC1=CC=C(C=C1)Br)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.971779