SpectraBase Compound ID | 8ceChxpipFj |
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InChI | InChI=1S/C7H14ClN/c1-6(5-8)9-7(2,3)4/h5H2,1-4H3/b9-6+ |
InChIKey | FOIFEJXQIBJYFJ-RMKNXTFCSA-N |
Mol Weight | 147.65 g/mol |
Molecular Formula | C7H14ClN |
Exact Mass | 147.081477 g/mol |
SpectraBase Spectrum ID | 4ZzSj5reJC4 |
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Name | N-(1-Chloro-2-propylidene)-T-butylamine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 147.081477155 u |
Formula | C7H14ClN |
InChI | InChI=1S/C7H14ClN/c1-6(5-8)9-7(2,3)4/h5H2,1-4H3/b9-6+ |
InChIKey | FOIFEJXQIBJYFJ-RMKNXTFCSA-N |
Molecular Weight | 147.649 g/mol |
SMILES | C(\N=C\(CCl)C)(C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.953444 |