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5-Apin N,N-bis(4-bromobenzyl)

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

5-Apin N,N-bis(4-bromobenzyl)
SpectraBase Compound ID EX2kRq6BpOf
InChI InChI=1S/C25H24Br2N2/c1-18(14-21-6-11-25-22(15-21)12-13-28-25)29(16-19-2-7-23(26)8-3-19)17-20-4-9-24(27)10-5-20/h2-13,15,18,28H,14,16-17H2,1H3
InChIKey YACSNVMRMLMMAA-UHFFFAOYSA-N
Mol Weight 512.29 g/mol
Molecular Formula C25H24Br2N2
Exact Mass 510.030625 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6c57XkZP1th
Name 5-Apin N,N-bis(4-bromobenzyl)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 510.030624781 u
Formula C25H24Br2N2
InChI InChI=1S/C25H24Br2N2/c1-18(14-21-6-11-25-22(15-21)12-13-28-25)29(16-19-2-7-23(26)8-3-19)17-20-4-9-24(27)10-5-20/h2-13,15,18,28H,14,16-17H2,1H3
InChIKey YACSNVMRMLMMAA-UHFFFAOYSA-N
Molecular Weight 512.289 g/mol
SMILES C12=C(NC=C2)C=CC(=C1)CC(N(CC=1C=CC(=CC1)Br)CC1=CC=C(C=C1)Br)C