SpectraBase Compound ID | 23Gsr3P8iWs |
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InChI | InChI=1S/C13H19N/c1-12(8-6-7-11-14-2)13-9-4-3-5-10-13/h3-5,9-10,14H,1,6-8,11H2,2H3 |
InChIKey | WDHHYLWITFZEGY-UHFFFAOYSA-N |
Mol Weight | 189.3 g/mol |
Molecular Formula | C13H19N |
Exact Mass | 189.15175 g/mol |
SpectraBase Spectrum ID | 46PnMJOSRn4 |
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Name | N-Methyl-5-phenyl-5-hexen-1-amine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 189.151749616 u |
Formula | C13H19N |
InChI | InChI=1S/C13H19N/c1-12(8-6-7-11-14-2)13-9-4-3-5-10-13/h3-5,9-10,14H,1,6-8,11H2,2H3 |
InChIKey | WDHHYLWITFZEGY-UHFFFAOYSA-N |
Molecular Weight | 189.302 g/mol |
SMILES | C(C=1C=CC=CC1)(=C)CCCCNC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.981622 |