SpectraBase Compound ID | Ko7OUHWWFXd |
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InChI | InChI=1S/C12H17N/c1-3-13(4-2)11-10-12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3/b11-10+ |
InChIKey | DPLUMPJQXVYXBH-ZHACJKMWSA-N |
Mol Weight | 175.27 g/mol |
Molecular Formula | C12H17N |
Exact Mass | 175.1361 g/mol |
SpectraBase Spectrum ID | AJMYNKOkFV4 |
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Name | (E)-N-(2-Phenylethenyl)-diethylamine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 175.136099551 u |
Formula | C12H17N |
InChI | InChI=1S/C12H17N/c1-3-13(4-2)11-10-12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3/b11-10+ |
InChIKey | DPLUMPJQXVYXBH-ZHACJKMWSA-N |
Molecular Weight | 175.275 g/mol |
SMILES | C1(\C=C\N(CC)CC)=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.819983 |