![4-Benzyl-1-phenylmorpholino[4,3-a][1,3,5]triazolium chloride](/api/spectrum/D32E485m2ue/structure.png?h=300&w=458 "4-Benzyl-1-phenylmorpholino[4,3-a][1,3,5]triazolium chloride")
| SpectraBase Compound ID | INin3j5RhwN |
|---|---|
| InChI | InChI=1S/C18H18N3O.ClH/c1-3-7-15(8-4-1)11-17-12-22-13-18-19-21(14-20(17)18)16-9-5-2-6-10-16;/h1-10,14,17H,11-13H2;1H/q+1;/p-1/t17-;/m0./s1 |
| InChIKey | HKRUMTQXZQXXLY-LMOVPXPDSA-M |
| Mol Weight | 327.82 g/mol |
| Molecular Formula | C18H18ClN3O |
| Exact Mass | 327.11384 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | D32E485m2ue |
|---|---|
| Name | 4-Benzyl-1-phenylmorpholino[4,3-a][1,3,5]triazolium chloride |
| Alternate Name(s) | (5S)-2-phenyl-5-(phenylmethyl)-6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-4-ium chloride (5S)-5-benzyl-2-phenyl-2H,5H,6H,8H-[1,2,4]triazolo[3,4-c][1,4]oxazin-4-ium chloride (5S)-5-benzyl-2-phenyl-6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-4-ium chloride (5S)-2-phenyl-5-(phenylmethyl)-6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-4-ium;chloride |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H18ClN3O |
| InChI | InChI=1S/C18H18N3O.ClH/c1-3-7-15(8-4-1)11-17-12-22-13-18-19-21(14-20(17)18)16-9-5-2-6-10-16;/h1-10,14,17H,11-13H2;1H/q+1;/p-1/t17-;/m0./s1 |
| InChIKey | HKRUMTQXZQXXLY-LMOVPXPDSA-M |
| Molecular Weight | 327.815 g/mol |
| SMILES | [Cl-].c12[n+](c[n](n2)-c2ccccc2)[C@](COC1)(Cc1ccccc1)[H] |
| SPLASH | splash10-0006-9150000000-d776d8204b09f148e987 |
| Source of Spectrum | KC-0-1892-13 |
| Wiley ID | 825508 |