SpectraBase Compound ID | DIPDVqMbt0D |
---|---|
InChI | InChI=1S/C12H14S/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1,3-5,7-9,12H,2,6,10H2 |
InChIKey | BLLCYRJKWFMGRL-UHFFFAOYSA-N |
Mol Weight | 190.3 g/mol |
Molecular Formula | C12H14S |
Exact Mass | 190.081622 g/mol |
SpectraBase Spectrum ID | AguCODaE8wO |
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Name | (1-Cyclohex-2-enylthio)benzene |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 190.081621625 u |
Formula | C12H14S |
InChI | InChI=1S/C12H14S/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1,3-5,7-9,12H,2,6,10H2 |
InChIKey | BLLCYRJKWFMGRL-UHFFFAOYSA-N |
Molecular Weight | 190.304 g/mol |
SMILES | C=1(SC2C=CCCC2)C=CC=CC1 |