| SpectraBase Compound ID | 4vb1lrIZb3n |
|---|---|
| InChI | InChI=1S/C9H16O2S/c1-5-6-7(12-4)8(10)9(2,3)11/h5,7,11H,1,6H2,2-4H3 |
| InChIKey | ZAVIQFCWMNSLBP-UHFFFAOYSA-N |
| Mol Weight | 188.28 g/mol |
| Molecular Formula | C9H16O2S |
| Exact Mass | 188.087101 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LITt6TA1FKy |
|---|---|
| Name | 2-HYDROXY-2-METHYL-4-METHYLSULFANYLHEPT-6-EN-3-ONE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H16O2S |
| InChI | InChI=1S/C9H16O2S/c1-5-6-7(12-4)8(10)9(2,3)11/h5,7,11H,1,6H2,2-4H3 |
| InChIKey | ZAVIQFCWMNSLBP-UHFFFAOYSA-N |
| Molecular Weight | 188.0867 |
| SMILES | OC(C(C(CC=C)SC)=O)(C)C |
| SPLASH | splash10-0a4i-9100000000-2f60b9fcfeba82075e92 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |