SpectraBase Compound ID | 2YSfiuEFZ7S |
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InChI | InChI=1S/C8H18ClN/c1-7(2)10(6-5-9)8(3)4/h7-8H,5-6H2,1-4H3 |
InChIKey | DBVADBHSJCWFKI-UHFFFAOYSA-N |
Mol Weight | 163.69 g/mol |
Molecular Formula | C8H18ClN |
Exact Mass | 163.112777 g/mol |
SpectraBase Spectrum ID | IPpENEYA9hB |
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Name | 2-(N,N-Diisopropylamino)ethylchloride |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 163.112777284 u |
Formula | C8H18ClN |
InChI | InChI=1S/C8H18ClN/c1-7(2)10(6-5-9)8(3)4/h7-8H,5-6H2,1-4H3 |
InChIKey | DBVADBHSJCWFKI-UHFFFAOYSA-N |
Molecular Weight | 163.692 g/mol |
SMILES | C(CN(C(C)C)C(C)C)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.938801 |