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3-me-4-ma N,N-bis(4-Chlorobenzyl)
SpectraBase Compound ID 1QtOzZDCOFa
InChI InChI=1S/C25H27Cl2NO/c1-18-14-22(8-13-25(18)29-3)15-19(2)28(16-20-4-9-23(26)10-5-20)17-21-6-11-24(27)12-7-21/h4-14,19H,15-17H2,1-3H3
InChIKey SCBKRBRXVNGORO-UHFFFAOYSA-N
Mol Weight 428.4 g/mol
Molecular Formula C25H27Cl2NO
Exact Mass 427.14697 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 518ygRiDxsi
Name 3-me-4-ma N,N-bis(4-Chlorobenzyl)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 427.146969892 u
Formula C25H27Cl2NO
InChI InChI=1S/C25H27Cl2NO/c1-18-14-22(8-13-25(18)29-3)15-19(2)28(16-20-4-9-23(26)10-5-20)17-21-6-11-24(27)12-7-21/h4-14,19H,15-17H2,1-3H3
InChIKey SCBKRBRXVNGORO-UHFFFAOYSA-N
Molecular Weight 428.403 g/mol
SMILES C(N(CC=1C=CC(=CC1)Cl)CC=1C=CC(=CC1)Cl)(CC1=CC(=C(C=C1)OC)C)C