| SpectraBase Spectrum ID |
JPMBj98k4Rz |
| Name |
2-ethyl-4-(4-methylphenyl)sulfonyl-1,4-dihydroisoquinolin-3-one |
| Alternate Name(s) |
2-ethyl-4-(p-tolylsulfonyl)-1,4-dihydroisoquinolin-3-one
2-ethyl-4-tosyl-1,4-dihydroisoquinolin-3-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H19NO3S |
| InChI |
InChI=1S/C18H19NO3S/c1-3-19-12-14-6-4-5-7-16(14)17(18(19)20)23(21,22)15-10-8-13(2)9-11-15/h4-11,17H,3,12H2,1-2H3 |
| InChIKey |
IZNYQBJJSJWKKC-UHFFFAOYSA-N |
| Molecular Weight |
329.414 g/mol |
| SMILES |
C1(S(c2ccc(cc2)C)(=O)=O)C(N(CC)Cc2c1cccc2)=O |
| SPLASH |
splash10-0002-0900000000-1a872365de102362c1cb |
| Source of Spectrum |
J-59-6118-5 |
| Wiley ID |
1327088 |
