SpectraBase Compound ID | GddOO0KLtsX |
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InChI | InChI=1S/C9H17NO3/c1-2-13-9(12)6-4-3-5-7-10-8-11/h8H,2-7H2,1H3,(H,10,11) |
InChIKey | LVLDVHLLPXAJBW-UHFFFAOYSA-N |
Mol Weight | 187.24 g/mol |
Molecular Formula | C9H17NO3 |
Exact Mass | 187.120843 g/mol |
SpectraBase Spectrum ID | AQUx8ccLxcd |
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Name | Ethyl 6-formamidohexanoate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 187.120843408 u |
Formula | C9H17NO3 |
InChI | InChI=1S/C9H17NO3/c1-2-13-9(12)6-4-3-5-7-10-8-11/h8H,2-7H2,1H3,(H,10,11) |
InChIKey | LVLDVHLLPXAJBW-UHFFFAOYSA-N |
Molecular Weight | 187.239 g/mol |
SMILES | CCOC(CCCCCNC=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.980009 |