| SpectraBase Spectrum ID |
HmYVGja15se |
| Name |
1,3,5-Tris-{3-[(benzylamino)methyl]phenyl}benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
663.361348461 u |
| Formula |
C48H45N3 |
| InChI |
InChI=1S/C48H45N3/c1-4-13-37(14-5-1)31-49-34-40-19-10-22-43(25-40)46-28-47(44-23-11-20-41(26-44)35-50-32-38-15-6-2-7-16-38)30-48(29-46)45-24-12-21-42(27-45)36-51-33-39-17-8-3-9-18-39/h1-30,49-51H,31-36H2 |
| InChIKey |
USTFHDANOUQXDX-UHFFFAOYSA-N |
| Molecular Weight |
663.909 g/mol |
| SMILES |
C=1(C=C(C=2C=C(CNCC=3C=CC=CC3)C=CC2)C=C(C1)C=1C=C(CNCC=2C=CC=CC2)C=CC1)C=1C=C(CNCC=2C=CC=CC2)C=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.982994 |
![1,3,5-Tris-{3-[(benzylamino)methyl]phenyl}benzene](/api/spectrum/HmYVGja15se/structure.png?h=300&w=458 "1,3,5-Tris-{3-[(benzylamino)methyl]phenyl}benzene")
