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| IUPAC Name: | 2,3,9,10-tetramethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium;chloride;hydrate |
| Description: | Palmatine Chloride (CAS# 171869-95-7) was an analyte studied via desorption electrospray ionization-mass spectrometry to help improve the analysis of sample spots on different surface types. |
| Molecular Weight: | 387.86 (anhydrous basis) |
| Molecular Formula: | C21H22ClNO4 · xH2O |
| Canonical SMILES: | COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC(=C(C=C4CC3)OC)OC)OC.O.[Cl-] |
| InChI: | InChI=1S/C21H22NO4.ClH.H2O/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4;;/h5-6,9-12H,7-8H2,1-4H3;1H;1H2/q+1;;/p-1 |
| InChI Key: | PIQNSCSNSSZUIT-UHFFFAOYSA-M |
| Appearance: | Yellow powder |
| MDL: | MFCD00150276 |
| LogP: | 0.32450 |
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