| SpectraBase Spectrum ID |
BEdO9x4wXgI |
| Name |
1,1-Dimethyl-9B.alpha.,2.alpha.-dimethoxy-1,2,3,9B-tetrahydro-5H-pyrrolo[2,1-A]isoindol-5-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.136493473 u |
| Formula |
C15H19NO3 |
| InChI |
InChI=1S/C15H19NO3/c1-14(2)12(18-3)9-16-13(17)10-7-5-6-8-11(10)15(14,16)19-4/h5-8,12H,9H2,1-4H3/t12-,15-/m1/s1 |
| InChIKey |
WTDHAVWPHSDGRQ-IUODEOHRSA-N |
| Molecular Weight |
261.321 g/mol |
| SMILES |
[C@]12(N(C(=O)C3=C2C=CC=C3)C[C@](C1(C)C)(OC)[H])OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922489 |
![1,1-Dimethyl-9b.alpha.,2.alpha.-dimethoxy-1,2,3,9b-tetrahydro-5H-pyrrolo[2,1-a]isoindol-5-one](/api/spectrum/BEdO9x4wXgI/structure.png?h=300&w=458 "1,1-Dimethyl-9b.alpha.,2.alpha.-dimethoxy-1,2,3,9b-tetrahydro-5H-pyrrolo[2,1-a]isoindol-5-one")
