| SpectraBase Spectrum ID |
D8xLRG4NyR |
| Name |
(4aS,8aS)-4-(4-methylphenyl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one |
| Alternate Name(s) |
(4aS,8aS)-4-(p-tolyl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H18N2O |
| InChI |
InChI=1S/C15H18N2O/c1-10-6-8-11(9-7-10)14-12-4-2-3-5-13(12)15(18)17-16-14/h6-9,12-13H,2-5H2,1H3,(H,17,18)/t12-,13-/m0/s1 |
| InChIKey |
CAGGMZIQVSXHRG-STQMWFEESA-N |
| Molecular Weight |
242.322 g/mol |
| SMILES |
N1C([C@]2(CCCC[C@@]2(C(=N1)c1ccc(cc1)C)[H])[H])=O |
| SPLASH |
splash10-000f-0890000000-5254934cf1ff44246f38 |
| Source of Spectrum |
H1-36-1818-3 |
| Wiley ID |
755266 |
