SpectraBase Compound ID | 7Up7ZP53uRL |
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InChI | InChI=1S/C13H21N/c1-11(2)14(12(3)4)10-13-8-6-5-7-9-13/h5-9,11-12H,10H2,1-4H3 |
InChIKey | GOTQULLXGZGQMK-UHFFFAOYSA-N |
Mol Weight | 191.32 g/mol |
Molecular Formula | C13H21N |
Exact Mass | 191.1674 g/mol |
SpectraBase Spectrum ID | CH4avkc5nZ0 |
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Name | N,N-di-iso-Propylbenzylamine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 191.167399680 u |
Formula | C13H21N |
InChI | InChI=1S/C13H21N/c1-11(2)14(12(3)4)10-13-8-6-5-7-9-13/h5-9,11-12H,10H2,1-4H3 |
InChIKey | GOTQULLXGZGQMK-UHFFFAOYSA-N |
Molecular Weight | 191.318 g/mol |
SMILES | C(N(C(C)C)C(C)C)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.939515 |