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2C-tbu N,N-bis(4-Chlorobenzyl)

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

2C-tbu N,N-bis(4-Chlorobenzyl)
SpectraBase Compound ID 4f8jmlTFsE
InChI InChI=1S/C28H33Cl2NO2/c1-28(2,3)25-17-26(32-4)22(16-27(25)33-5)14-15-31(18-20-6-10-23(29)11-7-20)19-21-8-12-24(30)13-9-21/h6-13,16-17H,14-15,18-19H2,1-5H3
InChIKey CKTZPGMPXBBXBT-UHFFFAOYSA-N
Mol Weight 486.5 g/mol
Molecular Formula C28H33Cl2NO2
Exact Mass 485.188835 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B2fm9GBMLIZ
Name 2C-tbu N,N-bis(4-Chlorobenzyl)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 485.188834705 u
Formula C28H33Cl2NO2
InChI InChI=1S/C28H33Cl2NO2/c1-28(2,3)25-17-26(32-4)22(16-27(25)33-5)14-15-31(18-20-6-10-23(29)11-7-20)19-21-8-12-24(30)13-9-21/h6-13,16-17H,14-15,18-19H2,1-5H3
InChIKey CKTZPGMPXBBXBT-UHFFFAOYSA-N
Molecular Weight 486.483 g/mol
SMILES C1(=C(C(C)(C)C)C=C(C(=C1)CCN(CC=1C=CC(=CC1)Cl)CC=1C=CC(=CC1)Cl)OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.850005