SpectraBase Compound ID | 8Gk8bnfv4E8 |
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InChI | InChI=1S/C10H21NO2/c1-4-6-7-9-11(8-5-2)10(12)13-3/h4-9H2,1-3H3 |
InChIKey | WJZVESMPGJTKKD-UHFFFAOYSA-N |
Mol Weight | 187.28 g/mol |
Molecular Formula | C10H21NO2 |
Exact Mass | 187.157229 g/mol |
SpectraBase Spectrum ID | 1kZfjNta3gU |
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Name | Carbonic acid, monoamide, N-propyl-N-pentyl-, methyl ester |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 187.157228918 u |
Formula | C10H21NO2 |
InChI | InChI=1S/C10H21NO2/c1-4-6-7-9-11(8-5-2)10(12)13-3/h4-9H2,1-3H3 |
InChIKey | WJZVESMPGJTKKD-UHFFFAOYSA-N |
Molecular Weight | 187.283 g/mol |
SMILES | C(N(CCC)CCCCC)(=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94417 |