| SpectraBase Spectrum ID |
CPoBOl6EcGb |
| Name |
3,3-Dimethoxy-3A,4,5,6-tetrahydro-1H-indol-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
197.105193344 u |
| Formula |
C10H15NO3 |
| InChI |
InChI=1S/C10H15NO3/c1-13-10(14-2)7-5-3-4-6-8(7)11-9(10)12/h6-7H,3-5H2,1-2H3,(H,11,12) |
| InChIKey |
IZDSHPBHFDXGNG-UHFFFAOYSA-N |
| Molecular Weight |
197.234 g/mol |
| SMILES |
C1(C(NC=2C1CCCC2)=O)(OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901164 |
