SpectraBase Compound ID | JFjgV8pFJBA |
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InChI | InChI=1S/C19H24N2O/c1-21(2,22)15-7-14-20-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)20/h3-6,8-11H,7,12-15H2,1-2H3 |
InChIKey | QZIQORUGXBPDSU-UHFFFAOYSA-N |
Mol Weight | 296.41 g/mol |
Molecular Formula | C19H24N2O |
Exact Mass | 296.188863 g/mol |
SpectraBase Spectrum ID | DDuP3SWwCta |
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Name | Imipraminoxide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 296.188863400 u |
Formula | C19H24N2O |
InChI | InChI=1S/C19H24N2O/c1-21(2,22)15-7-14-20-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)20/h3-6,8-11H,7,12-15H2,1-2H3 |
InChIKey | QZIQORUGXBPDSU-UHFFFAOYSA-N |
SMILES | C12=C(CCC=3C(N2CCCN(C)(C)=O)=CC=CC3)C=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.827595 |