| SpectraBase Spectrum ID |
LtxEr4spikA |
| Name |
2-Dimethylamino-3-methyl-6-(4-bromophenyl)-2,4-diphenyl-2H-pyrane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
445.104127396 u |
| Formula |
C26H24BrNO |
| InChI |
InChI=1S/C26H24BrNO/c1-19-24(20-10-6-4-7-11-20)18-25(21-14-16-23(27)17-15-21)29-26(19,28(2)3)22-12-8-5-9-13-22/h4-18H,1-3H3 |
| InChIKey |
KRBDRZWTDJUWNO-UHFFFAOYSA-N |
| Molecular Weight |
446.388 g/mol |
| SMILES |
C1(C(=C(C=C(O1)C=1C=CC(=CC1)Br)C=1C=CC=CC1)C)(C=1C=CC=CC1)N(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.891373 |
