| SpectraBase Spectrum ID |
6jf4buYbdjV |
| Name |
3,3-Dimethoxydecahydroazepino[3,2,1-hi]indol-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
253.167793602 u |
| Formula |
C14H23NO3 |
| InChI |
InChI=1S/C14H23NO3/c1-17-14(18-2)11-8-5-7-10-6-3-4-9-15(12(10)11)13(14)16/h10-12H,3-9H2,1-2H3/t10-,11-,12-/m1/s1 |
| InChIKey |
DIQRJMWWHHZIFC-IJLUTSLNSA-N |
| Molecular Weight |
253.342 g/mol |
| SMILES |
C1(N2[C@]3([C@](C1(OC)OC)(CCC[C@]3(CCCC2)[H])[H])[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.838279 |
![3,3-Dimethoxydecahydroazepino[3,2,1-hi]indol-2-one](/api/spectrum/6jf4buYbdjV/structure.png?h=300&w=458 "3,3-Dimethoxydecahydroazepino[3,2,1-hi]indol-2-one")
