| SpectraBase Spectrum ID |
AgEe1EbMyoz |
| Name |
1-Carbomethoxy-2-methyl-3-oxo-1,2,9,9A-tetrahydropyrrolo[1,2-A]indole |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
245.105193344 u |
| Formula |
C14H15NO3 |
| InChI |
InChI=1S/C14H15NO3/c1-8-12(14(17)18-2)11-7-9-5-3-4-6-10(9)15(11)13(8)16/h3-6,8,11-12H,7H2,1-2H3/t8-,11-,12+/m1/s1 |
| InChIKey |
OKLTWHUSJUCSDA-FXAINCCUSA-N |
| Molecular Weight |
245.278 g/mol |
| SMILES |
C1(N2[C@@]([C@]([C@]1(C)[H])(C(=O)OC)[H])(CC1=C2C=CC=C1)[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92125 |
![1-Carbomethoxy-2-methyl-3-oxo-1,2,9,9a-tetrahydropyrrolo[1,2-a]indole](/api/spectrum/AgEe1EbMyoz/structure.png?h=300&w=458 "1-Carbomethoxy-2-methyl-3-oxo-1,2,9,9a-tetrahydropyrrolo[1,2-a]indole")
