| SpectraBase Spectrum ID |
BqT8XWRazNv |
| Name |
2-Spirocyclopentyl-benzo[1,3]dioxole-5-carboxylic acid (3,4,5-trimethoxy-phenyl)-amide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
385.152537459 u |
| Formula |
C21H23NO6 |
| InChI |
InChI=1S/C21H23NO6/c1-24-17-11-14(12-18(25-2)19(17)26-3)22-20(23)13-6-7-15-16(10-13)28-21(27-15)8-4-5-9-21/h6-7,10-12H,4-5,8-9H2,1-3H3,(H,22,23) |
| InChIKey |
SJGDUMPMLYGYNI-UHFFFAOYSA-N |
| Molecular Weight |
385.416 g/mol |
| SMILES |
C(NC1=CC(=C(C(=C1)OC)OC)OC)(=O)C1=CC2=C(C=C1)OC1(O2)CCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.891573 |
![2-Spirocyclopentyl-benzo[1,3]dioxole-5-carboxylic acid (3,4,5-trimethoxy-phenyl)-amide](/api/spectrum/BqT8XWRazNv/structure.png?h=300&w=458 "2-Spirocyclopentyl-benzo[1,3]dioxole-5-carboxylic acid (3,4,5-trimethoxy-phenyl)-amide")
