SpectraBase Compound ID | 81U5dJRbK78 |
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InChI | InChI=1S/C13H23N/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h11-13H,1-10H2 |
InChIKey | NFTKQAPJKNGVSV-UHFFFAOYSA-N |
Mol Weight | 193.33 g/mol |
Molecular Formula | C13H23N |
Exact Mass | 193.18305 g/mol |
SpectraBase Spectrum ID | Jfohllb8h5g |
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Name | Dodecahydropyrido[1,2-B]isoquinoline |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 193.183049745 u |
Formula | C13H23N |
InChI | InChI=1S/C13H23N/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h11-13H,1-10H2 |
InChIKey | NFTKQAPJKNGVSV-UHFFFAOYSA-N |
Molecular Weight | 193.334 g/mol |
SMILES | C1CCCC2C1CN1CCCCC1C2 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.939457 |