SpectraBase Compound ID | BPKHrQojXDZ |
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InChI | InChI=1S/C11H15NO/c1-7-3-8-4-10(12)5-9(8)6-11(7)13-2/h3,6,10H,4-5,12H2,1-2H3 |
InChIKey | JLESVLCTIOAHPT-UHFFFAOYSA-N |
Mol Weight | 177.25 g/mol |
Molecular Formula | C11H15NO |
Exact Mass | 177.115364 g/mol |
SpectraBase Spectrum ID | E7ZacRPJFFs |
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Name | Mmai |
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/c1-7-3-8-4-10(12)5-9(8)6-11(7)13-2/h3,6,10H,4-5,12H2,1-2H3 |
InChIKey | JLESVLCTIOAHPT-UHFFFAOYSA-N |
Molecular Weight | 177.247 g/mol |
SMILES | NC1CC=2C=C(C(=CC2C1)OC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.913958 |