SpectraBase Compound ID | 9WIgFvimKMh |
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InChI | InChI=1S/C17H32O/c1-3-5-7-9-12-16-14-11-15-17(18-16)13-10-8-6-4-2/h11,14,16-17H,3-10,12-13,15H2,1-2H3/t16-,17+/m1/s1 |
InChIKey | PQUBBMFVNHJEET-SJORKVTESA-N |
Mol Weight | 252.4 g/mol |
Molecular Formula | C17H32O |
Exact Mass | 252.245316 g/mol |
SpectraBase Spectrum ID | GGMqHaTS59u |
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Name | (2S,6R)-2,6-Dihexyl-3,6-dihydro-2H-pyran |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 252.245315649 u |
Formula | C17H32O |
InChI | InChI=1S/C17H32O/c1-3-5-7-9-12-16-14-11-15-17(18-16)13-10-8-6-4-2/h11,14,16-17H,3-10,12-13,15H2,1-2H3/t16-,17+/m1/s1 |
InChIKey | PQUBBMFVNHJEET-SJORKVTESA-N |
Molecular Weight | 252.442 g/mol |
SMILES | [C@]1(O[C@](CC=C1)(CCCCCC)[H])(CCCCCC)[H] |