| SpectraBase Spectrum ID |
Kh1JW3OZOO1 |
| Name |
N-(6'-cyano-2',4',5'-trimethylbenzyl)-2,3,4,5,6-pentamethylbenzamide |
| Comments |
Note: The molecular formula of the structure shown is C23H28N2O - which differs from the formula reported for the mass spectrum (C24H30N2O) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H30N2O |
| InChI |
InChI=1S/C23H28N2O/c1-12-9-13(2)21(20(10-24)14(12)3)11-25-23(26)22-18(7)16(5)15(4)17(6)19(22)8/h9H,11H2,1-8H3,(H,25,26) |
| InChIKey |
SYZHCOVXYCTEAU-UHFFFAOYSA-N |
| Molecular Weight |
348.490 g/mol |
| SMILES |
N(C(c1c(c(c(c(c1C)C)C)C)C)=O)Cc1c(cc(c(c1C#N)C)C)C |
| SPLASH |
splash10-004i-0902000000-2b798e0b7f75b21b0659 |
| Source of Spectrum |
O1-32-1456-6 |
| Wiley ID |
819082 |
