SpectraBase Compound ID | 271u2gO54Gw |
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InChI | InChI=1S/C16H13ClN2O.ClH/c17-12-7-5-11(6-8-12)16(20)14-4-2-1-3-13(14)15-18-9-10-19(15)16;/h1-8,20H,9-10H2;1H |
InChIKey | NIUFFPYONFMTAH-UHFFFAOYSA-N |
Mol Weight | 321.21 g/mol |
Molecular Formula | C16H14Cl2N2O |
Exact Mass | 320.048318 g/mol |
SpectraBase Spectrum ID | E9p5se0aVQG |
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Name | Mazindol HC l inkbr |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 320.048318478 u |
Formula | C16H14Cl2N2O |
InChI | InChI=1S/C16H13ClN2O.ClH/c17-12-7-5-11(6-8-12)16(20)14-4-2-1-3-13(14)15-18-9-10-19(15)16;/h1-8,20H,9-10H2;1H |
InChIKey | NIUFFPYONFMTAH-UHFFFAOYSA-N |
SMILES | C=1(Cl)C=CC(C2(C=3C=CC=CC3C=3N2CCN3)O)=CC1.Cl |
Spectrum/Structure Validation Score (Raman) | 0.976137 |