SpectraBase Compound ID | 2rjiBR1dssu |
---|---|
InChI | InChI=1S/C12H17ClN2O2/c1-8-4-5-9(13)6-10(8)14-11(17)15-12(2,3)7-16/h4-6,16H,7H2,1-3H3,(H2,14,15,17) |
InChIKey | UUWOUWMHIRYISZ-UHFFFAOYSA-N |
Mol Weight | 256.73 g/mol |
Molecular Formula | C12H17ClN2O2 |
Exact Mass | 256.097855 g/mol |
SpectraBase Spectrum ID | Aedu7sVECEQ |
---|---|
Name | 1-(5-Chloro-o-tolyl)-3-(1,1-dimethyl-2-hydroxyethyl)urea |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 256.097855493 u |
Formula | C12H17ClN2O2 |
InChI | InChI=1S/C12H17ClN2O2/c1-8-4-5-9(13)6-10(8)14-11(17)15-12(2,3)7-16/h4-6,16H,7H2,1-3H3,(H2,14,15,17) |
InChIKey | UUWOUWMHIRYISZ-UHFFFAOYSA-N |
Molecular Weight | 256.733 g/mol |
SMILES | N(C1=CC(=CC=C1C)Cl)C(NC(CO)(C)C)=O |