| SpectraBase Spectrum ID |
3eRU1dYTx4Q |
| Name |
(3,4-Dimethoxyphenyl)-(3-methyl-2,4-dihydro-1H-isoquinolin-3-yl)methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
311.152143537 u |
| Formula |
C19H21NO3 |
| InChI |
InChI=1S/C19H21NO3/c1-19(11-14-6-4-5-7-15(14)12-20-19)18(21)13-8-9-16(22-2)17(10-13)23-3/h4-10,20H,11-12H2,1-3H3 |
| InChIKey |
ABAUVASAZDXUHQ-UHFFFAOYSA-N |
| Molecular Weight |
311.381 g/mol |
| SMILES |
C1(NCC2=C(C1)C=CC=C2)(C(C=1C=C(OC)C(=CC1)OC)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893945 |
