SpectraBase Compound ID | Dwtkn2Kf7Bx |
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InChI | InChI=1S/C9H19N.ClH/c1-8(10-2)7-9-5-3-4-6-9;/h8-10H,3-7H2,1-2H3;1H |
InChIKey | XGZPRABQSGUFBL-UHFFFAOYSA-N |
Mol Weight | 177.72 g/mol |
Molecular Formula | C9H20ClN |
Exact Mass | 177.128427 g/mol |
SpectraBase Spectrum ID | K7rMgLCBUnH |
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Name | Cyclopentamine HC l inkbr |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 177.128427348 u |
Formula | C9H20ClN |
InChI | InChI=1S/C9H19N.ClH/c1-8(10-2)7-9-5-3-4-6-9;/h8-10H,3-7H2,1-2H3;1H |
InChIKey | XGZPRABQSGUFBL-UHFFFAOYSA-N |
Molecular Weight | 177.719 g/mol |
SMILES | N(C(CC1CCCC1)C)C.Cl |
Spectrum/Structure Validation Score (Raman) | 0.964462 |