| SpectraBase Spectrum ID |
Ijb6q33SGFC |
| Name |
4',6'-Dimethoxy-4-dimethylamino-2'-(2-methylpropyl)oxychalcone (isomer 1) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
383.209658414 u |
| Formula |
C23H29NO4 |
| InChI |
InChI=1S/C23H29NO4/c1-16(2)15-28-22-14-19(26-5)13-21(27-6)23(22)20(25)12-9-17-7-10-18(11-8-17)24(3)4/h7-14,16H,15H2,1-6H3/b12-9+ |
| InChIKey |
ZKLDPBAGKNIZOZ-FMIVXFBMSA-N |
| Molecular Weight |
383.488 g/mol |
| SMILES |
C1(=C(C=C(C=C1OC)OC)OCC(C)C)C(\C=C\C=1C=CC(N(C)C)=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969727 |
