| SpectraBase Compound ID | 67EMrTA6ymV |
|---|---|
| InChI | InChI=1S/C12H14S2/c1-2-5-11(6-3-1)7-4-8-12-13-9-10-14-12/h1-3,5-6,8H,4,7,9-10H2 |
| InChIKey | BVNJBODOHSMKEH-UHFFFAOYSA-N |
| Mol Weight | 222.36 g/mol |
| Molecular Formula | C12H14S2 |
| Exact Mass | 222.053693 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JtnKB0xvYsS |
|---|---|
| Name | 2-(3'-Phenylpropylidene)-1,3-dithiolane |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H14S2 |
| InChI | InChI=1S/C12H14S2/c1-2-5-11(6-3-1)7-4-8-12-13-9-10-14-12/h1-3,5-6,8H,4,7,9-10H2 |
| InChIKey | BVNJBODOHSMKEH-UHFFFAOYSA-N |
| Molecular Weight | 222.364 g/mol |
| SMILES | C1(SCCS1)=CCCc1ccccc1 |
| SPLASH | splash10-0a4i-0490000000-0b6007ea9e02b687aa80 |
| Source of Spectrum | SK-23-3182-0 |
| Wiley ID | 865937 |