SpectraBase Compound ID | 4mivs2wnIZm |
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InChI | InChI=1S/C10H20ClNO/c1-3-5-6-8-12(7-4-2)10(13)9-11/h3-9H2,1-2H3 |
InChIKey | GBRYTVZWMVFWIF-UHFFFAOYSA-N |
Mol Weight | 205.73 g/mol |
Molecular Formula | C10H20ClNO |
Exact Mass | 205.123342 g/mol |
SpectraBase Spectrum ID | C2VUCT2tJ5s |
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Name | Acetamide, 2-chloro-N-propyl-N-pentyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 205.123341967 u |
Formula | C10H20ClNO |
InChI | InChI=1S/C10H20ClNO/c1-3-5-6-8-12(7-4-2)10(13)9-11/h3-9H2,1-2H3 |
InChIKey | GBRYTVZWMVFWIF-UHFFFAOYSA-N |
Molecular Weight | 205.729 g/mol |
SMILES | C(=O)(N(CCC)CCCCC)CCl |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.955849 |