SpectraBase Spectrum ID |
71hiHv7onNN |
Name |
2-[bis(Phenylmethyl)amino]-6-nitro-3-phenyl-3,4-dihydroquinolin-4-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
463.189591674 u |
Formula |
C29H25N3O3 |
InChI |
InChI=1S/C29H25N3O3/c33-28-25-18-24(32(34)35)16-17-26(25)30-29(27(28)23-14-8-3-9-15-23)31(19-21-10-4-1-5-11-21)20-22-12-6-2-7-13-22/h1-18,27-28,33H,19-20H2 |
InChIKey |
PFXQHTIPPQLDJA-UHFFFAOYSA-N |
Molecular Weight |
463.537 g/mol |
SMILES |
C1(=NC=2C=CC(N(=O)=O)=CC2C(C1C=1C=CC=CC1)O)N(CC=1C=CC=CC1)CC=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957134 |