| SpectraBase Spectrum ID |
AzUVZ53q8Tt |
| Name |
6-(1-(N-(2-Dimethoxyethyl)amino)-1-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzodioxin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
419.194402271 u |
| Formula |
C22H29NO7 |
| InChI |
InChI=1S/C22H29NO7/c1-24-18-11-15(12-19(25-2)22(18)28-5)21(23-13-20(26-3)27-4)14-6-7-16-17(10-14)30-9-8-29-16/h6-7,10-12,20-21,23H,8-9,13H2,1-5H3 |
| InChIKey |
KKSVASBQDOQETP-UHFFFAOYSA-N |
| Molecular Weight |
419.474 g/mol |
| SMILES |
C1(C(C=2C=C3OCCOC3=CC2)NCC(OC)OC)=CC(OC)=C(C(=C1)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959843 |
