| ||||||
| ||||||
| ||||||
| ||||||
| ||||||
| ||||||
| ||||||
| ||||||
| ||||||
| ||||||
| ||||||
| ||||||
| ||||||
| ||||||
| ||||||
| ||||||
SpectraBase Compound ID | AtGlDzf88qr |
---|---|
InChI | InChI=1S/C12H22O2/c1-5-6-8(2)11-9(3)7-10(4)12(13)14-11/h8-11H,5-7H2,1-4H3/t8-,9-,10-,11+/m1/s1 |
InChIKey | AZBHSLUQWMFDHU-DBIOUOCHSA-N |
Mol Weight | 198.31 g/mol |
Molecular Formula | C12H22O2 |
Exact Mass | 198.16198 g/mol |
SpectraBase Spectrum ID | 8F68NIMjwNL |
---|---|
Name | 3,5-Dimethyl-6-(1-methylbutyl)tetrahydropyran-2-one |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 198.161979946 u |
Formula | C12H22O2 |
InChI | InChI=1S/C12H22O2/c1-5-6-8(2)11-9(3)7-10(4)12(13)14-11/h8-11H,5-7H2,1-4H3/t8-,9-,10-,11+/m1/s1 |
InChIKey | AZBHSLUQWMFDHU-DBIOUOCHSA-N |
Molecular Weight | 198.306 g/mol |
SMILES | C1(O[C@]([C@@](C[C@]1(C)[H])(C)[H])([C@@](CCC)(C)[H])[H])=O |