SpectraBase Compound ID | 9DuM2Sglyip |
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InChI | InChI=1S/C11H21N/c1-5-7-11(9-10(3)4)12-8-6-2/h5-6,10-12H,1-2,7-9H2,3-4H3 |
InChIKey | IZXWQTDGZWRLAP-UHFFFAOYSA-N |
Mol Weight | 167.3 g/mol |
Molecular Formula | C11H21N |
Exact Mass | 167.1674 g/mol |
SpectraBase Spectrum ID | DtzdWQGPNs1 |
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Name | N-Allyl-6-methylhept-1-en-4-amine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 167.167399680 u |
Formula | C11H21N |
InChI | InChI=1S/C11H21N/c1-5-7-11(9-10(3)4)12-8-6-2/h5-6,10-12H,1-2,7-9H2,3-4H3 |
InChIKey | IZXWQTDGZWRLAP-UHFFFAOYSA-N |
Molecular Weight | 167.296 g/mol |
SMILES | C(=C)CNC(CC(C)C)CC=C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.908029 |