| SpectraBase Spectrum ID |
AViPRPTXdpC |
| Name |
(1S,2S,8as)-1,2-Diacetyloxy-2,3,6,8A-tetrahydro-5(1H)-indolizinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
253.095022582 u |
| Formula |
C12H15NO5 |
| InChI |
InChI=1S/C12H15NO5/c1-7(14)17-10-6-13-9(4-3-5-11(13)16)12(10)18-8(2)15/h3-4,9-10,12H,5-6H2,1-2H3/t9-,10-,12-/m0/s1 |
| InChIKey |
BHNDKCPPDJBQQC-NHCYSSNCSA-N |
| Molecular Weight |
253.254 g/mol |
| SMILES |
[C@@]1([C@](CN2C(CC=C[C@@]12[H])=O)(OC(=O)C)[H])(OC(=O)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.818846 |
