| SpectraBase Spectrum ID |
GEbCHCnCrnp |
| Name |
6,7-Dimethoxy-1-(trans-2'-phenylcyclopropyl)-3,4-dihydroisoquinoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
307.157228918 u |
| Formula |
C20H21NO2 |
| InChI |
InChI=1S/C20H21NO2/c1-22-18-10-14-8-9-21-20(16(14)12-19(18)23-2)17-11-15(17)13-6-4-3-5-7-13/h3-7,10,12,15,17H,8-9,11H2,1-2H3/t15-,17-/m1/s1 |
| InChIKey |
SIFBSYNJDNNLHW-NVXWUHKLSA-N |
| Molecular Weight |
307.393 g/mol |
| SMILES |
[C@@]1(C=2C=3C=C(OC)C(=CC3CCN2)OC)([C@@](C=2C=CC=CC2)(C1)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.920638 |
