SpectraBase Compound ID | 30SazgO2I1T |
---|---|
InChI | InChI=1S/C16H19NO2/c1-17-10-9-16(8-7-13(18)11-15(16)17)12-3-5-14(19-2)6-4-12/h3-8,15H,9-11H2,1-2H3 |
InChIKey | CJFZJWKORSTYPX-UHFFFAOYSA-N |
Mol Weight | 257.33 g/mol |
Molecular Formula | C16H19NO2 |
Exact Mass | 257.141579 g/mol |
SpectraBase Spectrum ID | 4aX3Z1WxbUD |
---|---|
Name | 4'-o-Methyl-sceletone P643 |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 257.141578854 u |
Formula | C16H19NO2 |
InChI | InChI=1S/C16H19NO2/c1-17-10-9-16(8-7-13(18)11-15(16)17)12-3-5-14(19-2)6-4-12/h3-8,15H,9-11H2,1-2H3 |
InChIKey | CJFZJWKORSTYPX-UHFFFAOYSA-N |
Molecular Weight | 257.333 g/mol |
SMILES | C1C2N(CCC2(C2=CC=C(C=C2)OC)C=CC1=O)C |