| SpectraBase Compound ID | 4DPOrdkN45W |
|---|---|
| InChI | InChI=1S/C10H12OS/c11-8-4-5-9-12-10-6-2-1-3-7-10/h1-3,6-8H,4-5,9H2 |
| InChIKey | GCZRORCGBSJNGZ-UHFFFAOYSA-N |
| Mol Weight | 180.26 g/mol |
| Molecular Formula | C10H12OS |
| Exact Mass | 180.060886 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3oEenRdlE7E |
|---|---|
| Name | 4-(Phenylthio)butanal |
| Alternate Name(s) | 4-Phenylsulfanylbutanal |
| CAS Registry Number | 77657-90-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H12OS |
| InChI | InChI=1S/C10H12OS/c11-8-4-5-9-12-10-6-2-1-3-7-10/h1-3,6-8H,4-5,9H2 |
| InChIKey | GCZRORCGBSJNGZ-UHFFFAOYSA-N |
| Molecular Weight | 180.265 g/mol |
| SMILES | C(=O)CCCSc1ccccc1 |
| SPLASH | splash10-0239-1900000000-2e49f550e831bc2a4fc0 |
| Source of Spectrum | F-42-6079-0 |
| Wiley ID | 1176063 |