SpectraBase Compound ID | 2l1Is7wAIKI |
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InChI | InChI=1S/C8H13NO/c1-7(10)9-8-5-3-2-4-6-8/h3,5,8H,2,4,6H2,1H3,(H,9,10) |
InChIKey | ZYVQVLHBHMJVEO-UHFFFAOYSA-N |
Mol Weight | 139.2 g/mol |
Molecular Formula | C8H13NO |
Exact Mass | 139.099714 g/mol |
SpectraBase Spectrum ID | 8H6ENxk536F |
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Name | N-(1-Cyclohex-2-enyl)acetamide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 139.099714042 u |
Formula | C8H13NO |
InChI | InChI=1S/C8H13NO/c1-7(10)9-8-5-3-2-4-6-8/h3,5,8H,2,4,6H2,1H3,(H,9,10) |
InChIKey | ZYVQVLHBHMJVEO-UHFFFAOYSA-N |
Molecular Weight | 139.198 g/mol |
SMILES | C(NC1C=CCCC1)(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.990597 |