SpectraBase Compound ID | 8ZY9KpP50uq |
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InChI | InChI=1S/C11H15NO/c1-2-4-9-6-7-10-5-3-8-12(10)11(9)13/h6-7H,2-5,8H2,1H3 |
InChIKey | XIVRTTQFCXQRIP-UHFFFAOYSA-N |
Mol Weight | 177.25 g/mol |
Molecular Formula | C11H15NO |
Exact Mass | 177.115364 g/mol |
SpectraBase Spectrum ID | 3Mm1qHPXoQ9 |
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Name | 6-Propyl-2,3-dihydro-1H-indolizin-5-one |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 177.115364106 u |
Formula | C11H15NO |
InChI | InChI=1S/C11H15NO/c1-2-4-9-6-7-10-5-3-8-12(10)11(9)13/h6-7H,2-5,8H2,1H3 |
InChIKey | XIVRTTQFCXQRIP-UHFFFAOYSA-N |
Molecular Weight | 177.247 g/mol |
SMILES | C1(N2C(=CC=C1CCC)CCC2)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.829215 |